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Substance Name: (2-Bromoethyl)benzene
RN: 103-63-9
UNII: 96O442668X
InChIKey: WMPPDTMATNBGJN-UHFFFAOYSA-N
Molecular Formula
- C8-H9-Br
Molecular Weight
- 185.063
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- (2-Bromoethyl)benzene
Synonyms
- (2-Bromoethyl)benzene
- 1-Bromo-2-phenylethane
- 2-Phenethyl bromide
- 2-Phenyl-1-bromoethane
- 2-Phenylethyl bromide
- AI3-11264
- Benzene, (2-bromoethyl)-
- beta-Bromoethylbenzene
- EINECS 203-130-8
- HSDB 5352
- NSC 33926
- Phenethyl bromide
- Phenylethyl bromide
- Phenylethyl bromide (VAN)
- UNII-96O442668X
Systematic Names
- 1-Bromo-2-phenylethane
- Benzene, (2-bromoethyl)-
Registry Numbers
CAS Registry Number
- 103-63-9
FDA UNII
- 96O442668X
System Generated Number
- 0000103639
Structure Descriptors
InChI
InChI=1S/C8H9Br/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2InChIKey
WMPPDTMATNBGJN-UHFFFAOYSA-NSmiles
BrCCc1ccccc1Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LD50 | oral | 811mg/kg (811mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS LUNGS, THORAX, OR RESPIRATION: DYSPNEA | National Technical Information Service. Vol. OTS0536710, |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | -6.57E+01 | deg C | EXP | |
Boiling Point | 219 | deg C | EXP | |
log P (octanol-water) | 3.09 | (none) | EXP | |
Water Solubility | 39.1 | mg/L | 25 | EXP |
Vapor Pressure | 0.245 | mm Hg | 25 | EXP |
Henry's Law Constant | 1.52E-03 | atm-m3/mole | 25 | EST |
Atmospheric OH Rate Constant | 5.60E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.