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15031-90-0 | 2-Piperidinone, 1,4-dimethyl-
CAS No: 15031-90-0 Catalog No: AG001MHY MDL No:
Product Description
Catalog Number:
AG001MHY
Chemical Name:
2-Piperidinone, 1,4-dimethyl-
CAS Number:
15031-90-0
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
IUPAC Name:
1,4-dimethylpiperidin-2-one
InChI:
InChI=1S/C7H13NO/c1-6-3-4-8(2)7(9)5-6/h6H,3-5H2,1-2H3
InChI Key:
JBCMUNOVVMEKMO-UHFFFAOYSA-N
SMILES:
CC1CCN(C(=O)C1)C
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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