1-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide

Modify Date: 2025-08-25 19:12:31

1-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide Structure
1-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide structure
Common Name 1-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide
CAS Number 88598-54-3 Molecular Weight 347.32100
Density N/A Boiling Point N/A
Molecular Formula C20H13NO5 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name Benzo[10,11]chryseno[3,4-b]oxirene-7,8-diol, 7,8,8a,9a-tetrahydro-1-nitro-, (7α,8β,8aα,9aα)
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C20H13NO5
Molecular Weight 347.32100
Exact Mass 347.07900
PSA 98.81000
LogP 3.86320
InChIKey AAZXENNZBMLJIW-ZMTPEHOPSA-N
SMILES O=[N+]([O-])c1ccc2ccc3cc4c(c5ccc1c2c35)C1OC1C(O)C4O

 Synonyms

BENZO[10,11]CHRYSENO[3,4-B]OXIRENE-7,8-DIOL,7,8,8A,9A-TETRAHYDRO-1-NITRO-, (7A,8B,8AA,9AA)-
trans-7,8-Dihydroxy-anti-9,10-epoxy-7,8,9,10-tetrahydro-1-nitrobenzo[a]pyrene
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