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Substance Name: 1-Bromo-3-methylbutane
RN: 107-82-4
UNII: CZM50594QA
InChIKey: YXZFFTJAHVMMLF-UHFFFAOYSA-N

Molecular Formula

  • C5-H11-Br

Molecular Weight

  • 151.046
 
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Names and Synonyms

Name of Substance

  • 1-Bromo-3-methylbutane

Synonyms

  • 1-Bromo-3-methylbutane
  • 3-Methylbutyl bromide
  • 4-Bromo-2-methylbutane
  • EINECS 203-522-9
  • HSDB 7381
  • Isoamyl bromide
  • Isobutylmethyl bromide
  • Isopentyl bromide
  • NSC 9240
  • UNII-CZM50594QA

Systematic Names

  • 1-Bromo-3-methylbutane
  • Butane, 1-bromo-3-methyl-

Superlist Names

  • 1-Bromo-3-methylbutane [UN2341] [Flammable liquid]
  • UN2341

Registry Numbers

CAS Registry Number

  • 107-82-4

FDA UNII

  • CZM50594QA

System Generated Number

  • 0000107824

Structure Descriptors

InChI

1S/C5H11Br/c1-5(2)3-4-6/h5H,3-4H2,1-2H3

InChIKey

YXZFFTJAHVMMLF-UHFFFAOYSA-N

Smiles

C(C(C)C)CBr

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LC50 inhalation 21300mg/m3 (21300mg/m3)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 18(4), Pg. 55, 1974.
mouse LD50 intraperitoneal 420mg/kg (420mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 20(12), Pg. 52, 1976.
rat LD50 intraperitoneal 6150mg/kg (6150mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 76, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.12E+02 deg C   EXP
Boiling Point 120.4 deg C   EXP
log P (octanol-water) 3.070 (none)   EST
Water Solubility 196 mg/L 25 EXP
Vapor Pressure 34.6 mm Hg 25 EXP
Henry's Law Constant 0.0346 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 3.57E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.