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875433-10-6 | 1-Propanone, 1-(4-bromophenyl)-3-cyclopentyl-
CAS No: 875433-10-6 Catalog No: AG004H29 MDL No:
Product Description
Catalog Number:
AG004H29
Chemical Name:
1-Propanone, 1-(4-bromophenyl)-3-cyclopentyl-
CAS Number:
875433-10-6
Molecular Formula:
C14H17BrO
Molecular Weight:
281.1882
IUPAC Name:
1-(4-bromophenyl)-3-cyclopentylpropan-1-one
InChI:
InChI=1S/C14H17BrO/c15-13-8-6-12(7-9-13)14(16)10-5-11-3-1-2-4-11/h6-9,11H,1-5,10H2
InChI Key:
VCFADFTWRDTKPC-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Br)CCC1CCCC1
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.193g/mol
Monoisotopic Mass:
280.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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