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247112-91-0 | 2-Piperidinecarboxylic acid, 5-amino-6-oxo-
CAS No: 247112-91-0 Catalog No: AG002P58 MDL No:
Product Description
Catalog Number:
AG002P58
Chemical Name:
2-Piperidinecarboxylic acid, 5-amino-6-oxo-
CAS Number:
247112-91-0
Molecular Formula:
C6H10N2O3
Molecular Weight:
158.1552
IUPAC Name:
5-amino-6-oxopiperidine-2-carboxylic acid
InChI:
InChI=1S/C6H10N2O3/c7-3-1-2-4(6(10)11)8-5(3)9/h3-4H,1-2,7H2,(H,8,9)(H,10,11)
InChI Key:
PXGAAHSFAXAXBD-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC(C(=O)N1)N
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
158.157g/mol
Monoisotopic Mass:
158.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.5
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