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Structure

6-(Bromomethyl)benzo[a]pyrene

CAS
49852-85-9
Catalog Number
ACM49852859
Category
Other Products
Molecular Weight
345.232 g/mol
Molecular Formula
C21H13Br

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Specification

Synonyms
6-Bromomethylbenzo(a)pyrene, CCRIS 2792, BENZO(a)PYRENE, 6-BROMOMETHYL-, CID39559, BRN 2468290, LS-39936, 49852-85-9
IUPAC Name
6-(bromomethyl)benzo[a]pyrene
Canonical SMILES
C1=CC=C2C(=C1)C3=C4C(=C2CBr)C=CC5=CC=CC(=C54)C=C3
InChI Key
DMAOOKLAQXNHTK-UHFFFAOYSA-N
Boiling Point
530ºC at 760 mmHg
Flash Point
268.8ºC
Density
1.53g/cm³
Exact Mass
344.02000
H-Bond Acceptor
0
H-Bond Donor
0
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