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benzo[a]pyren-12-ylmethanol

benzo[a]pyren-12-ylmethanol structure

CAS No:
94500-43-3
Formula:
C21H14O
Chemical Name:
benzo[a]pyren-12-ylmethanol
Synonyms:
12-HMBP;12-hydroxymethylbenzo(a)pyrene;12-Hydroxymethylbenzo(a)pyrene;94500-43-3;12-HYDROXYMETHYLBENZO[A]PYRENE;CCRIS 5476;DTXSID80241510

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benzo[a]pyren-12-ylmethanol Basic Attributes

Molecular Weight：

282.3 g/mol

Exact Mass：

282.104465066 g/mol

DSSTox ID：

DTXSID80241510

Characteristics

PSA：

20.2 Å²

Drug Information

MeSH Entry Terms：

12-HMBP

Computed Properties

Molecular Weight:282.3
XLogP3:5.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:282.104465066
Monoisotopic Mass:282.104465066
Topological Polar Surface Area:20.2
Heavy Atom Count:22
Complexity:418
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of benzo[a]pyren-12-ylmethanol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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