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165385-85-3 | 2-Piperidinone, 3-ethyl-
CAS No: 165385-85-3 Catalog No: AG001W43 MDL No:MFCD13178750
Product Description
Catalog Number:
AG001W43
Chemical Name:
2-Piperidinone, 3-ethyl-
CAS Number:
165385-85-3
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
MDL Number:
MFCD13178750
IUPAC Name:
3-ethylpiperidin-2-one
InChI:
InChI=1S/C7H13NO/c1-2-6-4-3-5-8-7(6)9/h6H,2-5H2,1H3,(H,8,9)
InChI Key:
OALIFKZSZCONPI-UHFFFAOYSA-N
SMILES:
CCC1CCCNC1=O
Properties
Complexity:
112
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:
1
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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