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101183-80-6 | 2-Propen-1-one, 1-(1-cyclohexen-1-yl)-3-phenyl-, (2E)-
CAS No: 101183-80-6 Catalog No: AG0003WH MDL No:
Product Description
Catalog Number:
AG0003WH
Chemical Name:
2-Propen-1-one, 1-(1-cyclohexen-1-yl)-3-phenyl-, (2E)-
CAS Number:
101183-80-6
Molecular Formula:
C15H16O
Molecular Weight:
212.2869
IUPAC Name:
1-(cyclohexen-1-yl)-3-phenylprop-2-en-1-one
InChI:
InChI=1S/C15H16O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1,3-4,7-9,11-12H,2,5-6,10H2
InChI Key:
FWERWJYBTDORDX-UHFFFAOYSA-N
SMILES:
O=C(C1=CCCCC1)/C=C/c1ccccc1
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.12g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.292g/mol
Monoisotopic Mass:
212.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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