4,5-Epoxy-1-nitro-4,5-dihydrobenzo(e)pyrene

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Names

[ CAS No. ]:
115664-49-8

[ Name ]:
4,5-Epoxy-1-nitro-4,5-dihydrobenzo(e)pyrene

[Synonym ]:
4,5-Epoxy-1-nitro-4,5-dihydrobenzo(e)pyrene
Benzo(e)pyrene,4,5-dihydro-4,5-epoxy-1-nitro
Benzo[9,10]pyreno[4,5-b]oxirene,3b,4a-dihydro-1-nitro

Chemical & Physical Properties

[ Density]:
1.53g/cm3

[ Boiling Point ]:
587.6ºC at 760mmHg

[ Molecular Formula ]:
C20H11NO3

[ Molecular Weight ]:
313.30600

[ Flash Point ]:
273ºC

[ Exact Mass ]:
313.07400

[ PSA ]:
58.35000

[ LogP ]:
5.70360

[ Vapour Pressure ]:
3.6E-13mmHg at 25°C

[ Index of Refraction ]:
1.876

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DJ5052000
CHEMICAL NAME :
Benzo(e)pyrene, 4,5-dihydro-4,5-epoxy-1-nitro-
CAS REGISTRY NUMBER :
115664-49-8
LAST UPDATED :
199706
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H11-N-O3
MOLECULAR WEIGHT :
313.32

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
2500 ng/plate
REFERENCE :
CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House, Southfield Road, Eynsham, Oxford OX8 1JJ, UK) V.1- 1980- Volume(issue)/page/year: 9,951,1988

Related Compounds

  • cis-4,5-Dihydroxy-4,5-dihydrobenzo[e]pyrene
  • 6,7-dihydrobenzo[e]pyrene-6,7-diol
  • 4,5-DIHYDRO-NAPHTHO[1,2-D]THIAZOL-2-YLAMINE
  • 1-Nitropyrene-4,5-oxide
  • 6-nitro-4,5-dihydrobenzo[a]pyrene
  • Acetamide, N-(4,5-dihydronaphtho[1,2-d]thiazol-2-yl)-
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 1'-ethyl-2',3'-dihydro-1'H-spiro[piperidine-4,4'-quinoline]-2'-one
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide