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851956-01-9 | (S);-Piperidine-3-carboxylic acid hydrochloride
CAS No: 851956-01-9 Catalog No: AG004W29 MDL No:MFCD00211281
Product Description
Catalog Number:
AG004W29
Chemical Name:
(S);-Piperidine-3-carboxylic acid hydrochloride
CAS Number:
851956-01-9
Molecular Formula:
C6H12ClNO2
Molecular Weight:
165.6180
MDL Number:
MFCD00211281
IUPAC Name:
(3S)-piperidine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H11NO2.ClH/c8-6(9)5-2-1-3-7-4-5;/h5,7H,1-4H2,(H,8,9);1H/t5-;/m0./s1
InChI Key:
LRZWUDOLANRDSF-JEDNCBNOSA-N
SMILES:
OC(=O)[C@H]1CCCNC1.Cl
UNII:
7R91429V3L
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
165.056g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
165.617g/mol
Monoisotopic Mass:
165.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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