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3-nitrobenzo[a]pyrene-6-carbonitrile

3-nitrobenzo[a]pyrene-6-carbonitrile structure

CAS No:
143265-29-6
Formula:
C21H10N2O2
Chemical Name:
3-nitrobenzo[a]pyrene-6-carbonitrile
Synonyms:
Benzo(a)pyrene-6-carbonitrile, 3-nitro-;3-Nitrobenzo(a)pyrene-6-carbonitrile;3-nitrobenzo[a]pyrene-6-carbonitrile;143265-29-6;3-Nitro-6-cyanobenzo(a)pyrene;DTXSID80162372

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3-nitrobenzo[a]pyrene-6-carbonitrile Basic Attributes

Molecular Weight：

322.3 g/mol

Exact Mass：

322.074227566 g/mol

DSSTox ID：

DTXSID80162372

Characteristics

PSA：

69.6 Å²

Computed Properties

Molecular Weight:322.3
XLogP3:6
Hydrogen Bond Acceptor Count:3
Exact Mass:322.074227566
Monoisotopic Mass:322.074227566
Topological Polar Surface Area:69.6
Heavy Atom Count:25
Complexity:605
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-nitrobenzo[a]pyrene-6-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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