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116140-49-9 | 3-Piperidinecarboxylic acid, 3-methyl-
CAS No: 116140-49-9 Catalog No: AG000BQ5 MDL No:MFCD12024776
Product Description
Catalog Number:
AG000BQ5
Chemical Name:
3-Piperidinecarboxylic acid, 3-methyl-
CAS Number:
116140-49-9
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
MDL Number:
MFCD12024776
IUPAC Name:
3-methylpiperidine-3-carboxylic acid
InChI:
InChI=1S/C7H13NO2/c1-7(6(9)10)3-2-4-8-5-7/h8H,2-5H2,1H3,(H,9,10)
InChI Key:
DEMOKNSWMVAJPZ-UHFFFAOYSA-N
SMILES:
OC(=O)C1(C)CCCNC1
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
2
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.1
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