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Substance Name: alpha-Bromocinnamaldehyde
RN: 5443-49-2
InChIKey: WQRWNOKNRHCLHV-TWGQIWQCSA-N

Note

  • Anti-mildew agent.

Classification Code

  • Mutation Data

Molecular Formula

  • C9-H7-Br-O

Molecular Weight

  • 211.0573
 
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Names and Synonyms

Name of Substance

  • 2-Propenal, 2-bromo-3-phenyl-
  • alpha-Bromocinnamaldehyde
  • Bromocinnamal

Synonyms

  • 2-07-00-00281 (Beilstein Handbook Reference)
  • 2-Bromo-3-phenyl-2-propenal
  • 2-Bromocinnamaldehyde
  • alpha-Bromocinnamaldehyde
  • alpha-Bromocinnamic aldehyde
  • Alphabrocine
  • B 36
  • B 37
  • B 37 (VAN)
  • BRN 1099733
  • CCRIS 3924
  • EINECS 226-637-6
  • NSC 19806

Systematic Names

  • 2-Bromocinnamaldehyde
  • 2-Propenal, 2-bromo-3-phenyl- (9CI)
  • alpha-Bromocinnamaldehyde
  • Cinnamaldehyde, alpha-bromo-

Registry Numbers

CAS Registry Number

  • 5443-49-2

System Generated Number

  • 0005443492

Structure Descriptors

InChI

1S/C9H7BrO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-7H/b9-6-

InChIKey

WQRWNOKNRHCLHV-TWGQIWQCSA-N

Smiles

c1(\C=C(\C=O)Br)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 822mg/kg (822mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969.
mouse LD50 oral 470mg/kg (470mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

BEHAVIORAL: ATAXIA
Science Reports of the Research Institutes, Tohoku University, Series C: Medicine. Vol. 36(1-4), Pg. 10, 1989.
mouse LD50 subcutaneous 2200mg/kg (2200mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969.
rat LD50 intraperitoneal 513mg/kg (513mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969.
rat LD50 oral 1450mg/kg (1450mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969.
rat LD50 subcutaneous 1210mg/kg (1210mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969.