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132452-24-5 | Cyclopentanone, 2-[(2-bromophenyl)methyl]-
CAS No: 132452-24-5 Catalog No: AG0010PH MDL No:
Product Description
Catalog Number:
AG0010PH
Chemical Name:
Cyclopentanone, 2-[(2-bromophenyl)methyl]-
CAS Number:
132452-24-5
Molecular Formula:
C12H13BrO
Molecular Weight:
253.1350
IUPAC Name:
2-[(2-bromophenyl)methyl]cyclopentan-1-one
InChI:
InChI=1S/C12H13BrO/c13-11-6-2-1-4-9(11)8-10-5-3-7-12(10)14/h1-2,4,6,10H,3,5,7-8H2
InChI Key:
IHJKRELWANHJRL-UHFFFAOYSA-N
SMILES:
O=C1CCCC1Cc1ccccc1Br
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.015g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.139g/mol
Monoisotopic Mass:
252.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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