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Structure

5-Bromoacenaphthene

CAS
2051-98-1
Catalog Number
ACM2051981
Category
Other Products
Molecular Weight
233.1g/mol
Molecular Formula
C12H9Br

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Specification

IUPAC Name
5-bromo-1,2-dihydroacenaphthylene
Canonical SMILES
C1CC2=CC=C(C3=CC=CC1=C23)Br
InChI
InChI=1S/C12H9Br/c13-11-7-6-9-5-4-8-2-1-3-10(11)12(8)9/h1-3,6-7H,4-5H2
InChI Key
QALKJGMGKYKMKE-UHFFFAOYSA-N
Boiling Point
335.0 °C
Melting Point
52.0 °C
Complexity
201
Covalently-Bonded Unit Count
1
EC Number
218-138-7
Exact Mass
231.98876g/mol
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
13
Monoisotopic Mass
231.98876g/mol
NSC Number
59823
Rotatable Bond Count
0
XLogP3
4.7
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