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276248-50-1 | 3-Piperidinecarboxylic acid, methyl ester, (3S)-
CAS No: 276248-50-1 Catalog No: AG002U9J MDL No:MFCD09752680
Product Description
Catalog Number:
AG002U9J
Chemical Name:
3-Piperidinecarboxylic acid, methyl ester, (3S)-
CAS Number:
276248-50-1
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
MDL Number:
MFCD09752680
IUPAC Name:
methyl (3S)-piperidine-3-carboxylate
InChI:
InChI=1S/C7H13NO2/c1-10-7(9)6-3-2-4-8-5-6/h6,8H,2-5H2,1H3/t6-/m0/s1
InChI Key:
BCDBHIAXYFPJCT-LURJTMIESA-N
SMILES:
COC(=O)[C@H]1CCCNC1
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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