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136312-85-1 | 2-Piperidinecarboxylic acid, 1-methyl-, hydrochloride (1:1), (2S)-
CAS No: 136312-85-1 Catalog No: AG0011M5 MDL No:MFCD01570459
Product Description
Catalog Number:
AG0011M5
Chemical Name:
2-Piperidinecarboxylic acid, 1-methyl-, hydrochloride (1:1), (2S)-
CAS Number:
136312-85-1
Molecular Formula:
C7H14ClNO2
Molecular Weight:
179.6446
MDL Number:
MFCD01570459
IUPAC Name:
1-methylpiperidine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H13NO2.ClH/c1-8-5-3-2-4-6(8)7(9)10;/h6H,2-5H2,1H3,(H,9,10);1H
InChI Key:
HENMKHNMVUDRMJ-UHFFFAOYSA-N
SMILES:
CN1CCCC[C@H]1C(=O)O.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.071g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.644g/mol
Monoisotopic Mass:
179.071g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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