1-Nitrosopyrene

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Names

[ CAS No. ]:
86674-51-3

[ Name ]:
1-Nitrosopyrene

[Synonym ]:
Pyrene,1-nitroso
1-nitroso-pyrene
1-Nitroso-pyren

Chemical & Physical Properties

[ Density]:
1.29g/cm3

[ Boiling Point ]:
434.3ºC at 760 mmHg

[ Molecular Formula ]:
C16H9NO

[ Molecular Weight ]:
231.24900

[ Flash Point ]:
179.3ºC

[ Exact Mass ]:
231.06800

[ PSA ]:
29.43000

[ LogP ]:
4.98190

[ Index of Refraction ]:
1.715

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UR2490000
CHEMICAL NAME :
Pyrene, 1-nitroso-
CAS REGISTRY NUMBER :
86674-51-3
LAST UPDATED :
199410
DATA ITEMS CITED :
14
MOLECULAR FORMULA :
C16-H19-N-O
MOLECULAR WEIGHT :
241.36
WISWESSER LINE NOTATION :
L666 B6 2AB PJ DNO

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
386 mg/kg/16W-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Skin and Appendages - tumors

MUTATION DATA

TYPE OF TEST :
Mutation in mammalian somatic cells
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
20 umol/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 161,99,1986

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1-Nitropyrene
  • aminopyrene
  • N-hydroxy-2-aminopyrene
  • Diethyl ether
  • Sulfuric acid

DownStream

  • aminopyrene

Related Compounds

  • 1-Nitro-6-nitrosopyrene
  • 1-Nitro-8-nitrosopyrene
  • 1-nitro-3-nitrosopyrene
  • 1-[2-(2-fluorobenzoyl)pyrrol-1-yl]propan-2-yl-dimethylazanium,chloride
  • 1-[1-(5-chloro-2-pyridinyl)-5-methyl-1H-pyrazol-4-yl]-1-ethanone
  • 1-Tridecanamine
  • tert-Butyl 2-(2-chloro-4-pyrimidinyl)-4-oxo-1,4,6,7-tetrahydro-5H-pyrrolo[3,2-c]pyridine-5-carboxylate
  • 2-(3-{3-[(tert-Butoxycarbonyl)amino]propyl}-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid
  • Benzyl 3-[(tert-butoxycarbonyl)(methyl)amino]cyclobutylcarbamate
  • 2-(3-{2-[(tert-Butoxycarbonyl)amino]ethyl}-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid
  • 1-(tert-Butyl) 2-methyl 3-(2-methoxybenzyl)-1,2-pyrrolidinedicarboxylate
  • 2-({[4-(4-Morpholinyl)-1H-indazol-3-yl]amino}carbonyl)benzoic acid
  • 4,6-Dichloro-5-nitro-2-[4-(1-piperidinylmethyl)phenyl]pyrimidine
  • 1-(tert-Butoxycarbonyl)-3-(3-methoxybenzyl)proline
  • Dimethyl 3-(dibenzylamino)-1,1-cyclobutanedicarboxylate
  • tert-Butyl 4-hydroxy-4-[2-(methoxycarbonyl)-1-benzofuran-6-yl]-1-piperidinecarboxylate
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