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123495-48-7 | 2-Piperidinecarboxylic acid, ethyl ester, hydrochloride (1:1), (2S)-
CAS No: 123495-48-7 Catalog No: AG000KOJ MDL No:MFCD09264372
Product Description
Catalog Number:
AG000KOJ
Chemical Name:
2-Piperidinecarboxylic acid, ethyl ester, hydrochloride (1:1), (2S)-
CAS Number:
123495-48-7
Molecular Formula:
C8H16ClNO2
Molecular Weight:
193.6711
MDL Number:
MFCD09264372
IUPAC Name:
ethyl (2S)-piperidine-2-carboxylate;hydrochloride
InChI:
InChI=1S/C8H15NO2.ClH/c1-2-11-8(10)7-5-3-4-6-9-7;/h7,9H,2-6H2,1H3;1H/t7-;/m0./s1
InChI Key:
KGAWPIXNSIYQPC-FJXQXJEOSA-N
SMILES:
CCOC(=O)[C@@H]1CCCCN1.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
193.087g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.671g/mol
Monoisotopic Mass:
193.087g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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