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1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene

1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene structure

CAS No:
88598-56-5
Formula:
C20H15NO2
Chemical Name:
1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene
Synonyms:
1-nitro-7,8,9,10-tetrahydrobenzo(a)pyrene;1-nitro-H(4)BAP;7,8,9,10-tetrahydro-1-nitrobenzo(a)pyrene;1-Nitro-7,8,9,10-tetrahydrobenzo(a)pyrene;88598-56-5;1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene;CCRIS 5869;BRN 6226550;7,8,9,10-Tetrahydro-1-nitrobenzo(a)pyrene;CHEMBL165080;BENZO(a)PYRENE, 7,8,9,10-TETRAHYDRO-1-NITRO-;DTXSID50237167;ZINC5845678

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1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene Basic Attributes

Molecular Weight：

301.3 g/mol

Exact Mass：

301.110278721 g/mol

DSSTox ID：

DTXSID50237167

Characteristics

PSA：

45.8 Å²

Drug Information

MeSH Entry Terms：

1-nitro-7,8,9,10-tetrahydrobenzo(a)pyrene

Computed Properties

Molecular Weight:301.3
XLogP3:6.2
Hydrogen Bond Acceptor Count:2
Exact Mass:301.110278721
Monoisotopic Mass:301.110278721
Topological Polar Surface Area:45.8
Heavy Atom Count:23
Complexity:487
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene

Basic Attributes
Characteristics
Drug Information
Computed Properties

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