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Substance Name: Bromobenzene
RN: 108-86-1
UNII: CO4D5J547L
InChIKey: QARVLSVVCXYDNA-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C6-H5-Br

Molecular Weight

  • 157.01
 
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Names and Synonyms

Name of Substance

  • Bromobenzene

Synonyms

  • AI3-09059
  • Benzene, bromo-
  • Bromobenzene
  • CCRIS 5887
  • EINECS 203-623-8
  • HSDB 47
  • Monobromobenzene
  • NCI-C55492
  • NSC 6529
  • Phenyl bromide
  • UNII-CO4D5J547L

Systematic Names

  • Benzene, bromo-
  • Bromobenzene

Superlist Names

  • Benzene, bromo-
  • Bromobenzene
  • Bromobenzene [UN2514] [Flammable liquid]
  • UN2514

Registry Numbers

CAS Registry Number

  • 108-86-1

FDA UNII

  • CO4D5J547L

System Generated Number

  • 0000108861

Structure Descriptors

InChI

1S/C6H5Br/c7-6-4-2-1-3-5-6/h1-5H

InChIKey

QARVLSVVCXYDNA-UHFFFAOYSA-N

Smiles

c1(ccccc1)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 1700mg/kg (1700mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 28, 1982.
mammal (species unspecified) LC50 inhalation 14400mg/m3 (14400mg/m3)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 18(4), Pg. 55, 1974.
mammal (species unspecified) LD50 oral 2700mg/kg (2700mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 32(10), Pg. 25, 1988.
mouse LC50 inhalation 21gm/m3/2H (21000mg/m3) BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 13(9), Pg. 56, 1969.
mouse LD50 intraperitoneal 817mg/kg (817mg/kg)   Mutagenesis. Vol. 2, Pg. 111, 1987.
mouse LD50 oral 2700mg/kg (2700mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 13(9), Pg. 56, 1969.
mouse LD50 subcutaneous 2gm/kg (2000mg/kg) PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
Japanese Journal of Pharmacology. Vol. 3, Pg. 99, 1954.
rabbit LD50 oral 3300mg/kg (3300mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 28, 1982.
rat LC50 inhalation 20411mg/m3 (20411mg/m3)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 19(9), Pg. 36, 1975.
rat LD50 intraperitoneal 3882mg/kg (3882mg/kg)   Toxicology and Applied Pharmacology. Vol. 83, Pg. 108, 1986.
rat LD50 oral 2383mg/kg (2383mg/kg) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

SENSE ORGANS AND SPECIAL SENSES: CHROMODACYRORREA: EYE
National Technical Information Service. Vol. OTS0571670,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.06E+01 deg C   EXP
Boiling Point 156 deg C   EXP
log P (octanol-water) 2.99 (none)   EXP
Water Solubility 446 mg/L 30 EXP
Vapor Pressure 4.18 mm Hg 25 EXP
Henry's Law Constant 0.00247 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 7.70E-13 cm3/molecule-sec 25 EXP

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