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16725-75-0 | 1-Butanone, 2-methyl-1-phenyl-, (2R)-
CAS No: 16725-75-0 Catalog No: AG001X7X MDL No:
Product Description
Catalog Number:
AG001X7X
Chemical Name:
1-Butanone, 2-methyl-1-phenyl-, (2R)-
CAS Number:
16725-75-0
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
IUPAC Name:
(2R)-2-methyl-1-phenylbutan-1-one
InChI:
InChI=1S/C11H14O/c1-3-9(2)11(12)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/t9-/m1/s1
InChI Key:
DGZJLMWKIQOQFA-SECBINFHSA-N
SMILES:
CC[C@H](C(=O)c1ccccc1)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
162.104g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.232g/mol
Monoisotopic Mass:
162.104g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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