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1254328-22-7 | 4-Piperidinecarboxylic acid, 2-methyl-, methyl ester, (2R,4R)-rel-
CAS No: 1254328-22-7 Catalog No: AG000NOZ MDL No:MFCD23105867
Product Description
Catalog Number:
AG000NOZ
Chemical Name:
4-Piperidinecarboxylic acid, 2-methyl-, methyl ester, (2R,4R)-rel-
CAS Number:
1254328-22-7
Molecular Formula:
C8H15NO2
Molecular Weight:
157.2102
MDL Number:
MFCD23105867
IUPAC Name:
methyl (2R,4R)-2-methylpiperidine-4-carboxylate
InChI:
InChI=1S/C8H15NO2/c1-6-5-7(3-4-9-6)8(10)11-2/h6-7,9H,3-5H2,1-2H3/t6-,7-/m1/s1
InChI Key:
LMRCYTXOCDKRRY-RNFRBKRXSA-N
SMILES:
COC(=O)[C@@H]1CCN[C@@H](C1)C
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
157.11g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.213g/mol
Monoisotopic Mass:
157.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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