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79120-96-0 | 2-Butanone, 3-phenyl-, (R)-
CAS No: 79120-96-0 Catalog No: AG005BN4 MDL No:
Product Description
Catalog Number:
AG005BN4
Chemical Name:
2-Butanone, 3-phenyl-, (R)-
CAS Number:
79120-96-0
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
IUPAC Name:
(3R)-3-phenylbutan-2-one
InChI:
InChI=1S/C10H12O/c1-8(9(2)11)10-6-4-3-5-7-10/h3-8H,1-2H3/t8-/m0/s1
InChI Key:
CVWMNAWLNRRPOL-QMMMGPOBSA-N
SMILES:
C[C@H](c1ccccc1)C(=O)C
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
148.089g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.205g/mol
Monoisotopic Mass:
148.089g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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