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187753-15-7 | 2-Piperidinecarboxylic acid, 4-oxo-, methyl ester
CAS No: 187753-15-7 Catalog No: AG002GH2 MDL No:MFCD12403905
Product Description
Catalog Number:
AG002GH2
Chemical Name:
2-Piperidinecarboxylic acid, 4-oxo-, methyl ester
CAS Number:
187753-15-7
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
MDL Number:
MFCD12403905
IUPAC Name:
methyl 4-oxopiperidine-2-carboxylate
InChI:
InChI=1S/C7H11NO3/c1-11-7(10)6-4-5(9)2-3-8-6/h6,8H,2-4H2,1H3
InChI Key:
RUTRXSXNELSCPP-UHFFFAOYSA-N
SMILES:
COC(=O)C1CC(=O)CCN1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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