|
|
|
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
* denotes mobile formatted website
Links to Resources
NLM Resources (File Locators)
Regulatory Agencies (Superlist Locators)
Other Resources (Internet Locators)
Search for this InChIKey on the Web
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.