3-nitrobenzo(a)pyrene

Modify Date: 2024-01-10 16:26:03

3-nitrobenzo(a)pyrene Structure
3-nitrobenzo(a)pyrene structure
Common Name 3-nitrobenzo(a)pyrene
CAS Number 70021-98-6 Molecular Weight 297.30700
Density 1.429g/cm3 Boiling Point 533.5ºC at 760 mmHg
Molecular Formula C20H11NO2 Melting Point N/A
MSDS N/A Flash Point 265.4ºC

 Names

Name 3-nitrobenzo[a]pyrene
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.429g/cm3
Boiling Point 533.5ºC at 760 mmHg
Molecular Formula C20H11NO2
Molecular Weight 297.30700
Flash Point 265.4ºC
Exact Mass 297.07900
PSA 45.82000
LogP 6.16860
Index of Refraction 1.901

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DJ7880000
CHEMICAL NAME :
Benzo(a)pyrene, 3-nitro-
CAS REGISTRY NUMBER :
70021-98-6
LAST UPDATED :
199801
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C20-H11-N-O2
MOLECULAR WEIGHT :
297.32
WISWESSER LINE NOTATION :
L D6 B6666 2AB TJ ONW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
DNA adduct
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
40 ug/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 379,43,1997

 Synthetic Route

~99%

3-nitrobenzo(a)pyrene Structure

3-nitrobenzo(a)...

CAS#:70021-98-6

Literature: Chou, M. W.; Heflich, R. H.; Casciano, D. A.; Miller, D. W.; Freeman, J. P.; et al. Journal of Medicinal Chemistry, 1984 , vol. 27, # 9 p. 1156 - 1161

~25%

3-nitrobenzo(a)pyrene Structure

3-nitrobenzo(a)...

CAS#:70021-98-6

Literature: Dyker, Gerald; Kadzimirsz, Daniel; Thoene, Andreas European Journal of Organic Chemistry, 2003 , # 16 p. 3162 - 3166

~%

3-nitrobenzo(a)pyrene Structure

3-nitrobenzo(a)...

CAS#:70021-98-6

Literature: Chou, M. W.; Heflich, R. H.; Casciano, D. A.; Miller, D. W.; Freeman, J. P.; et al. Journal of Medicinal Chemistry, 1984 , vol. 27, # 9 p. 1156 - 1161

~%

3-nitrobenzo(a)pyrene Structure

3-nitrobenzo(a)...

CAS#:70021-98-6

Literature: Dyker, Gerald; Kadzimirsz, Daniel; Thoene, Andreas European Journal of Organic Chemistry, 2003 , # 16 p. 3162 - 3166

~%

3-nitrobenzo(a)pyrene Structure

3-nitrobenzo(a)...

CAS#:70021-98-6

Literature: Johansen, Einar; Sydnes, Leiv K.; Greibrokk, Tyge Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, 1984 , vol. 38, # 4 p. 309 - 318

~0%

3-nitrobenzo(a)pyrene Structure

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CAS#:70021-98-6

Detail
Literature: Fukuhara; Miyata; Matsui; Ishidata Jr.; Kamiya Chemical and Pharmaceutical Bulletin, 1990 , vol. 38, # 11 p. 3158 - 3161

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3-nitrobenzo(a)pyrene Structure

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CAS#:70021-98-6

Detail
Literature: Ishii, Satoko; Hisamatsu, Yoshiharu; Inazu, Koji; Kobayashi, Takaaki; Aika, Ken-ichi Chemosphere, 2000 , vol. 41, # 11 p. 1809 - 1819

~%

3-nitrobenzo(a)pyrene Structure

3-nitrobenzo(a)...

CAS#:70021-98-6

Detail
Literature: Ishii, Satoko; Hisamatsu, Yoshiharu; Inazu, Koji; Kobayashi, Takaaki; Aika, Ken-ichi Chemosphere, 2000 , vol. 41, # 11 p. 1809 - 1819

~%

3-nitrobenzo(a)pyrene Structure

3-nitrobenzo(a)...

CAS#:70021-98-6

Literature: Dyker, Gerald; Kadzimirsz, Daniel; Thoene, Andreas European Journal of Organic Chemistry, 2003 , # 16 p. 3162 - 3166

 Synonyms

BENZO(a)PYRENE,3-NITRO
3-Nitrobenzo(a)pyrene
3-Nitrobenz(a)pyrene
3-Nitro-benzo[def]chrysene
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