(7S,8R,9S,10R)-7,8,9,10-Tetrahydro-9,10-epoxybenzo[a]pyrene-7,8-diol

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Names

[ CAS No. ]:
63323-29-5

[ Name ]:
(7S,8R,9S,10R)-7,8,9,10-Tetrahydro-9,10-epoxybenzo[a]pyrene-7,8-diol

Chemical & Physical Properties

[ Density]:
1.569g/cm3

[ Boiling Point ]:
594.2ºC at 760 mmHg

[ Molecular Formula ]:
C20H14O3

[ Molecular Weight ]:
302.32300

[ Flash Point ]:
313.2ºC

[ Exact Mass ]:
302.09400

[ PSA ]:
52.99000

[ LogP ]:
3.43180

[ Index of Refraction ]:
1.936

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DJ5055800
CHEMICAL NAME :
Benzo(a)pyrene, 7-alpha,8-beta-dihydroxy-9-alpha,10-alpha-epoxy-7,8,9 ,10-tetrahydro-, (+)-cis-
CAS REGISTRY NUMBER :
63323-29-5
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C20-H14-O3
MOLECULAR WEIGHT :
302.34

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1200 ug/kg
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Skin and Appendages - tumors

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
100 pmol/plate
REFERENCE :
BBRCA9 Biochemical and Biophysical Research Communications. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 77,1389,1977

Related Compounds

  • 1-[(2-Fluoro-4-nitrophenyl)methyl]cyclopropane-1-carboxylic acid
  • Methyl 4-amino-4-(3-fluoro-5-methylphenyl)butanoate
  • 3-(4-{[(Tert-butoxy)carbonyl]amino}-3-methylphenyl)-3-hydroxypropanoic acid
  • methyl 5-(azetidin-2-yl)-1-methyl-1H-pyrazole-4-carboxylate
  • 3-(2-{[(Tert-butoxy)carbonyl]amino}-4-(trifluoromethyl)phenyl)-2-oxopropanoic acid
  • tert-butyl N-(2-amino-3,3-difluoro-2-methylpropyl)-N-(propan-2-yl)carbamate
  • Methyl 5-(azetidin-2-yl)-2-methylfuran-3-carboxylate
  • tert-butyl N-methyl-N-{1-[1-(methylamino)cyclopropyl]propan-2-yl}carbamate
  • 2-[(2R)-1-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methoxybutanoyl]piperidin-2-yl]acetic acid
  • 1-[(3R)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoyl]-1H,2H,3H-pyrazolo[1,5-a]imidazole-7-carboxylic acid
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