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Benzodioxanes

Aromatic organic heterocyclic compounds that consist of benzene fused with a dioxane ring; dioxane rings are six-membered heterocyclic compounds with two oxygen atoms, and are considered ethers.

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1

2,3-Dihydro-1,4-benzodioxine-5-carbonitrile, 97%, Thermo Scientific™

CAS: 148703-14-4 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD01116986 InChI Key: WNNQCWLSQDNACP-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzo b 1,4 dioxine-5-carbonitrile,1,4-benzodioxin-5-carbonitrile,2,3-dihydro,acmc-1c2ut,2h,3h-benzo e 1,4-dioxane-5-carbonitrile PubChem CID: 2795043 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-5-carbonitrile SMILES: C1COC2=C(C=CC=C2O1)C#N

PubChem CID 2795043
CAS 148703-14-4
Molecular Weight (g/mol) 161.16
MDL Number MFCD01116986
SMILES C1COC2=C(C=CC=C2O1)C#N
Synonym 2,3-dihydrobenzo b 1,4 dioxine-5-carbonitrile,1,4-benzodioxin-5-carbonitrile,2,3-dihydro,acmc-1c2ut,2h,3h-benzo e 1,4-dioxane-5-carbonitrile
IUPAC Name 2,3-dihydro-1,4-benzodioxine-5-carbonitrile
InChI Key WNNQCWLSQDNACP-UHFFFAOYSA-N
Molecular Formula C9H7NO2
2

2,3-Dihydro-1,4-benzodioxine-5-carboxamide, 97%, Thermo Scientific™

CAS: 349550-81-8 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD03659722 InChI Key: OIYLTYTXMKZKCR-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzo b 1,4 dioxine-5-carboxamide,maybridge3_004369,2h,3h-benzo e 1,4-dioxane-5-carboxamide,1,4-benzodioxin-5-carboxamide,2,3-dihydro,5wy PubChem CID: 2779845 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-5-carboxamide SMILES: C1COC2=C(C=CC=C2O1)C(=O)N

PubChem CID 2779845
CAS 349550-81-8
Molecular Weight (g/mol) 179.175
MDL Number MFCD03659722
SMILES C1COC2=C(C=CC=C2O1)C(=O)N
Synonym 2,3-dihydrobenzo b 1,4 dioxine-5-carboxamide,maybridge3_004369,2h,3h-benzo e 1,4-dioxane-5-carboxamide,1,4-benzodioxin-5-carboxamide,2,3-dihydro,5wy
IUPAC Name 2,3-dihydro-1,4-benzodioxine-5-carboxamide
InChI Key OIYLTYTXMKZKCR-UHFFFAOYSA-N
Molecular Formula C9H9NO3
3

6-Iodo-1,4-benzodioxane, 95%, remainder mainly 5-isomer

CAS: 57744-67-9 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.05 MDL Number: MFCD00221460 InChI Key: HZTMYTXWFHBHDC-UHFFFAOYSA-N Synonym: 3,4-ethylenedioxyiodobenzene,6-iodo-2,3-dihydrobenzo b 1,4 dioxine,6-iodobenzodioxane,acmc-1azse,6-iodo-1,4-benzodioxane,6-iodo-2h,3h-benzo e 1,4-dioxin,2,3-dihydro-6-iodobenzo 1,4 dioxin,1,4-benzodioxin,2,3-dihydro-6-iodo PubChem CID: 2776176 IUPAC Name: 6-iodo-2,3-dihydro-1,4-benzodioxine SMILES: IC1=CC=C2OCCOC2=C1

PubChem CID 2776176
CAS 57744-67-9
Molecular Weight (g/mol) 262.05
MDL Number MFCD00221460
SMILES IC1=CC=C2OCCOC2=C1
Synonym 3,4-ethylenedioxyiodobenzene,6-iodo-2,3-dihydrobenzo b 1,4 dioxine,6-iodobenzodioxane,acmc-1azse,6-iodo-1,4-benzodioxane,6-iodo-2h,3h-benzo e 1,4-dioxin,2,3-dihydro-6-iodobenzo 1,4 dioxin,1,4-benzodioxin,2,3-dihydro-6-iodo
IUPAC Name 6-iodo-2,3-dihydro-1,4-benzodioxine
InChI Key HZTMYTXWFHBHDC-UHFFFAOYSA-N
Molecular Formula C8H7IO2
4

4,5-Dihydro-1,3-benzodioxine-6-amine, ≥97%, Thermo Scientific™

CAS: 22791-64-6 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00047632 InChI Key: MUSIFRYVOVSNMY-UHFFFAOYSA-N Synonym: 1,3-benzodioxan, 6-amino,4h-benzo d 1,3 dioxin-6-amine,6-amino-1,3-benzodioxane,2,4-dihydro-1,3-benzodioxin-6-amine,2h,4h-benzo e 1,3-dioxin-6-ylamine,6-amino-4h-1,3-benzodioxin,1,3-benzodioxan, 6-amino-, PubChem CID: 140959 SMILES: NC1=CC=C2OCOCC2=C1

PubChem CID 140959
CAS 22791-64-6
Molecular Weight (g/mol) 151.17
MDL Number MFCD00047632
SMILES NC1=CC=C2OCOCC2=C1
Synonym 1,3-benzodioxan, 6-amino,4h-benzo d 1,3 dioxin-6-amine,6-amino-1,3-benzodioxane,2,4-dihydro-1,3-benzodioxin-6-amine,2h,4h-benzo e 1,3-dioxin-6-ylamine,6-amino-4h-1,3-benzodioxin,1,3-benzodioxan, 6-amino-,
InChI Key MUSIFRYVOVSNMY-UHFFFAOYSA-N
Molecular Formula C8H9NO2
5

8-(chloromethyl)-6-fluoro-4H-1,3-benzodioxine, 97%, Thermo Scientific™

CAS: 131728-94-4 Molecular Formula: C9H8ClFO2 Molecular Weight (g/mol): 202.61 MDL Number: MFCD00052603 InChI Key: FMONGDHUPLQOCP-UHFFFAOYSA-N Synonym: 8-chloromethyl-6-fluoro-4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-4h-benzo d 1,3 dioxine,4h-1,3-benzodioxin,8-chloromethyl-6-fluoro,8-chloromethyl-6-fluoro-2,4-dihydro-1,3-benzodioxine,8-chloromethyl-6-fluorobenzo-1,3-dioxane,acmc-1c5x1,8-chloromethyl-6-fluoro-4h-benzo 1,3 dioxine,8-chloromethyl-6-fluoro-2h,4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-2h,4h-benzo e 1,3-dioxin PubChem CID: 2780137 IUPAC Name: 8-(chloromethyl)-6-fluoro-4H-1,3-benzodioxine SMILES: FC1=CC(CCl)=C2OCOCC2=C1

PubChem CID 2780137
CAS 131728-94-4
Molecular Weight (g/mol) 202.61
MDL Number MFCD00052603
SMILES FC1=CC(CCl)=C2OCOCC2=C1
Synonym 8-chloromethyl-6-fluoro-4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-4h-benzo d 1,3 dioxine,4h-1,3-benzodioxin,8-chloromethyl-6-fluoro,8-chloromethyl-6-fluoro-2,4-dihydro-1,3-benzodioxine,8-chloromethyl-6-fluorobenzo-1,3-dioxane,acmc-1c5x1,8-chloromethyl-6-fluoro-4h-benzo 1,3 dioxine,8-chloromethyl-6-fluoro-2h,4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-2h,4h-benzo e 1,3-dioxin
IUPAC Name 8-(chloromethyl)-6-fluoro-4H-1,3-benzodioxine
InChI Key FMONGDHUPLQOCP-UHFFFAOYSA-N
Molecular Formula C9H8ClFO2
7

2,3-Dihydro-1,4-benzodioxine-5-carbaldehyde, Thermo Scientific™

CAS: 29668-43-7 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00239451 InChI Key: BJXUCBAQZJITKD-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzo b 1,4 dioxine-5-carbaldehyde,2,3-dihydro-benzo 1,4 dioxine-5-carbaldehyde,1,4-benzodioxin-5-carboxaldehyde, 2,3-dihydro,2,3-dihydro-1,4-benzodioxine-5-carbaldehyd,2,3-dihydro-1,4-benzodioxin-5-carboxaldehyde,2,3-ethylenedioxybenzaldehyde,2,3-dihydrobenzodioxin-5-carboxaldehyde,1,4-benzodioxane-5-carboxaldehyde,2h,3h-benzo e 1,4-dioxin-5-carbaldehyde,2,3-dihydro-1,4-benzdioxin-5-carbaldehyde PubChem CID: 2795033 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-5-carbaldehyde SMILES: O=CC1=C2OCCOC2=CC=C1

PubChem CID 2795033
CAS 29668-43-7
Molecular Weight (g/mol) 164.16
MDL Number MFCD00239451
SMILES O=CC1=C2OCCOC2=CC=C1
Synonym 2,3-dihydrobenzo b 1,4 dioxine-5-carbaldehyde,2,3-dihydro-benzo 1,4 dioxine-5-carbaldehyde,1,4-benzodioxin-5-carboxaldehyde, 2,3-dihydro,2,3-dihydro-1,4-benzodioxine-5-carbaldehyd,2,3-dihydro-1,4-benzodioxin-5-carboxaldehyde,2,3-ethylenedioxybenzaldehyde,2,3-dihydrobenzodioxin-5-carboxaldehyde,1,4-benzodioxane-5-carboxaldehyde,2h,3h-benzo e 1,4-dioxin-5-carbaldehyde,2,3-dihydro-1,4-benzdioxin-5-carbaldehyde
IUPAC Name 2,3-dihydro-1,4-benzodioxine-5-carbaldehyde
InChI Key BJXUCBAQZJITKD-UHFFFAOYSA-N
Molecular Formula C9H8O3
10

6-Fluoro-4H-1,3-benzodioxine-8-carboxylic acid, 97%, Thermo Scientific™

CAS: 321309-28-8 Molecular Formula: C9H7FO4 Molecular Weight (g/mol): 198.149 MDL Number: MFCD02681981 InChI Key: HWBALMSPYAUMMB-UHFFFAOYSA-N Synonym: 6-fluoro-4h-benzo 1,3 dioxine-8-carboxylic acid,6-fluoro-2,4-dihydro-1,3-benzodioxine-8-carboxylic acid,6-fluoro-4h-benzo d 1,3 dioxine-8-carboxylic acid,6-fluoro-4h-1,3-benzodioxin-8-carboxylic acid,8-carboxy-6-fluoro-4h-1,3-benzodioxine,6-fluoro-1,3-benzodioxene-8-carboxylic acid,4h-1,3-benzodioxin-8-carboxylicacid, 6-fluoro,6-fluoranyl-4h-1,3-benzodioxine-8-carboxylic acid,6-fluoro-2h,4h-benzo e 1,3-dioxane-8-carboxylic acid,fbg PubChem CID: 2779901 IUPAC Name: 6-fluoro-4H-1,3-benzodioxine-8-carboxylic acid SMILES: C1C2=C(C(=CC(=C2)F)C(=O)O)OCO1

PubChem CID 2779901
CAS 321309-28-8
Molecular Weight (g/mol) 198.149
MDL Number MFCD02681981
SMILES C1C2=C(C(=CC(=C2)F)C(=O)O)OCO1
Synonym 6-fluoro-4h-benzo 1,3 dioxine-8-carboxylic acid,6-fluoro-2,4-dihydro-1,3-benzodioxine-8-carboxylic acid,6-fluoro-4h-benzo d 1,3 dioxine-8-carboxylic acid,6-fluoro-4h-1,3-benzodioxin-8-carboxylic acid,8-carboxy-6-fluoro-4h-1,3-benzodioxine,6-fluoro-1,3-benzodioxene-8-carboxylic acid,4h-1,3-benzodioxin-8-carboxylicacid, 6-fluoro,6-fluoranyl-4h-1,3-benzodioxine-8-carboxylic acid,6-fluoro-2h,4h-benzo e 1,3-dioxane-8-carboxylic acid,fbg
IUPAC Name 6-fluoro-4H-1,3-benzodioxine-8-carboxylic acid
InChI Key HWBALMSPYAUMMB-UHFFFAOYSA-N
Molecular Formula C9H7FO4
12

2-Bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone, 97%, Thermo Scientific™

CAS: 19815-97-5 Molecular Formula: C10H9BrO3 Molecular Weight (g/mol): 257.08 MDL Number: MFCD04972617 InChI Key: BSROYFIAEPSLCT-UHFFFAOYSA-N Synonym: 2-bromo-1-2,3-dihydrobenzo b 1,4 dioxin-5-yl ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl-1-ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,5-bromoacetyl-1,4-benzodioxane,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethan-1-one,5-bromoacetyl-2,3-dihydro-1,4-benzodioxine,2-bromanyl-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,1-2h,3h-benzo 2,3-e 1,4-dioxin-5-yl-2-bromoethan-1-one,ethanone, 2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl PubChem CID: 2795035 IUPAC Name: 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone SMILES: BrCC(=O)C1=C2OCCOC2=CC=C1

PubChem CID 2795035
CAS 19815-97-5
Molecular Weight (g/mol) 257.08
MDL Number MFCD04972617
SMILES BrCC(=O)C1=C2OCCOC2=CC=C1
Synonym 2-bromo-1-2,3-dihydrobenzo b 1,4 dioxin-5-yl ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl-1-ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,5-bromoacetyl-1,4-benzodioxane,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethan-1-one,5-bromoacetyl-2,3-dihydro-1,4-benzodioxine,2-bromanyl-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,1-2h,3h-benzo 2,3-e 1,4-dioxin-5-yl-2-bromoethan-1-one,ethanone, 2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl
IUPAC Name 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone
InChI Key BSROYFIAEPSLCT-UHFFFAOYSA-N
Molecular Formula C10H9BrO3
13

1,4-Benzodioxane-2-thiocarboxamide, 97%, Thermo Scientific™

CAS: 147031-85-4 Molecular Formula: C9H9NO2S Molecular Weight (g/mol): 195.236 MDL Number: MFCD00084889 InChI Key: ZOHVHNZPAGHKKO-UHFFFAOYSA-N Synonym: 2,3-dihydro-1,4-benzodioxine-2-carbothioamide,1,4-benzodioxane-2-thiocarboxamide,acmc-20aogq,maybridge1_004986,2,3-dihydro-1,4-benzodioxin-2-carbothioamide,1,4-benzodioxin-2-carbothioamide,2,3-dihydro,2,3-dihydrobenzo b 1,4 dioxine-2-carbothioamide,2h,3h-benzo e 1,4-dioxan-2-ylaminomethane-1-thione,1,4-benzodioxin-2-carbothioamide, 2,3-dihydro-9ci PubChem CID: 2779081 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-3-carbothioamide SMILES: C1C(OC2=CC=CC=C2O1)C(=S)N

PubChem CID 2779081
CAS 147031-85-4
Molecular Weight (g/mol) 195.236
MDL Number MFCD00084889
SMILES C1C(OC2=CC=CC=C2O1)C(=S)N
Synonym 2,3-dihydro-1,4-benzodioxine-2-carbothioamide,1,4-benzodioxane-2-thiocarboxamide,acmc-20aogq,maybridge1_004986,2,3-dihydro-1,4-benzodioxin-2-carbothioamide,1,4-benzodioxin-2-carbothioamide,2,3-dihydro,2,3-dihydrobenzo b 1,4 dioxine-2-carbothioamide,2h,3h-benzo e 1,4-dioxan-2-ylaminomethane-1-thione,1,4-benzodioxin-2-carbothioamide, 2,3-dihydro-9ci
IUPAC Name 2,3-dihydro-1,4-benzodioxine-3-carbothioamide
InChI Key ZOHVHNZPAGHKKO-UHFFFAOYSA-N
Molecular Formula C9H9NO2S
15

2-Chloromethyl-1,4-benzodioxane, 97%, Thermo Scientific™

CAS: 2164-33-2 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00014666 InChI Key: AYPKYQSHFKQVDL-UHFFFAOYSA-N Synonym: 2-chloromethyl-2,3-dihydro-1,4-benzodioxine,2-chloromethyl-1,4-benzodioxane,2-chloromethyl-2,3-dihydrobenzo b 1,4 dioxine,2-chloromethyl-2,3-dihydro-1,4-benzodioxin,2-chloromethyl-2,3-dihydro-benzo 1,4 dioxine,2-chloromethyl-2h,3h-benzo e 1,4-dioxane,acmc-1cfd2,2-chloromethyl-benzodioxane,2-chloromethyl-1,4-benzodioxan PubChem CID: 95320 IUPAC Name: 3-(chloromethyl)-2,3-dihydro-1,4-benzodioxine SMILES: C1C(OC2=CC=CC=C2O1)CCl

PubChem CID 95320
CAS 2164-33-2
Molecular Weight (g/mol) 184.619
MDL Number MFCD00014666
SMILES C1C(OC2=CC=CC=C2O1)CCl
Synonym 2-chloromethyl-2,3-dihydro-1,4-benzodioxine,2-chloromethyl-1,4-benzodioxane,2-chloromethyl-2,3-dihydrobenzo b 1,4 dioxine,2-chloromethyl-2,3-dihydro-1,4-benzodioxin,2-chloromethyl-2,3-dihydro-benzo 1,4 dioxine,2-chloromethyl-2h,3h-benzo e 1,4-dioxane,acmc-1cfd2,2-chloromethyl-benzodioxane,2-chloromethyl-1,4-benzodioxan
IUPAC Name 3-(chloromethyl)-2,3-dihydro-1,4-benzodioxine
InChI Key AYPKYQSHFKQVDL-UHFFFAOYSA-N
Molecular Formula C9H9ClO2