2-(3-Bromophenyl)oxirane

HCID 147193

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Basic information

CAS: 28022-44-8
Standard SMILES: Brc1cccc(C2CO2)c1
InChIKey: YUPLJNGZNHMXGM-UHFFFAOYSA-N
Molecular formula: C8H7BrO
Average molar mass: 199.04 g/mol
Monoisotopic mass: 197.96802694

Names & identifiers

Preferred name: 2-(3-Bromophenyl)oxirane
IUPAC: 2-(3-bromophenyl)oxirane
English name: m-Bromostyrene 7,8-oxide
Molecular formula: C8H7BrO
Molecular weight: 199.04

Names & synonyms

2-(3-bromophenyl)oxirane28022-44-8DTXSID80950711RefChem:455282DTXCID901378857838-078-0Oxirane, 2-(3-bromophenyl)-Oxirane, (3-bromophenyl)-131567-05-0MFCD016567863-bromostyrene oxidem-Bromostyrene 7,8-oxide

Show more names

m-Bromostyrene oxide(3-Bromophenyl)oxirane

BRN 13069391-Bromo-3-(epoxyethyl)benzeneBenzene, 1-bromo-3-(epoxyethyl)-2-(3-bromo-phenyl)-oxiraneSCHEMBL610893SCHEMBL27854229SCHEMBL29364885YUPLJNGZNHMXGM-UHFFFAOYSA-N

Database identifiers

CAS: 28022-44-8
PubChem CID: 147193
DTXSID: DTXSID80950711
EC Number: 838-078-0
Nikkaji: J1.325.209B

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 126

Physicochemical properties

Boiling point: 249 · 249 ºC
Density: 1.596 · 1.596
Flash point: 99 · 99 ºC
EWG's Food Scores: 1 · 1
Symbol(GHS): 8 · GHS08,GHS02,GHS07,GHS09
Signal word: Warning
Hazard statements: 341 · H341-H411-H226-H302
Precautionary statements: 201 · P201-P202-P281-P308+P313-P405-P501-P264-P270-P301+P312-P330-P501

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P203, P210, P233, P240, P241, P242, P243, P264, P270, P273, P280, P301+P317, P303+P361+P353, P318, P330, P370+P378, P391, P403+P235, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS08,GHS02,GHS07,GHS09
Hazard statements: H341-H411-H226-H302
Precautionary statements: P201-P202-P281-P308+P313-P405-P501-P264-P270-P301+P312-P330-P501