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14113-94-1 | Ethanone, 1-cyclopropyl-2-phenyl-
CAS No: 14113-94-1 Catalog No: AG001FYU MDL No:MFCD11934440
Product Description
Catalog Number:
AG001FYU
Chemical Name:
Ethanone, 1-cyclopropyl-2-phenyl-
CAS Number:
14113-94-1
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
MDL Number:
MFCD11934440
IUPAC Name:
1-cyclopropyl-2-phenylethanone
InChI:
InChI=1S/C11H12O/c12-11(10-6-7-10)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI Key:
RXZJHESCHPMWEK-UHFFFAOYSA-N
SMILES:
O=C(C1CC1)Cc1ccccc1
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.216g/mol
Monoisotopic Mass:
160.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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