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162648-33-1 | 4-Piperidinecarboxylic acid, 1,4-dimethyl-
CAS No: 162648-33-1 Catalog No: AG001TA0 MDL No:MFCD07787270
Product Description
Catalog Number:
AG001TA0
Chemical Name:
4-Piperidinecarboxylic acid, 1,4-dimethyl-
CAS Number:
162648-33-1
Molecular Formula:
C8H15NO2
Molecular Weight:
157.2102
MDL Number:
MFCD07787270
IUPAC Name:
1,4-dimethylpiperidine-4-carboxylic acid
InChI:
InChI=1S/C8H15NO2/c1-8(7(10)11)3-5-9(2)6-4-8/h3-6H2,1-2H3,(H,10,11)
InChI Key:
QBYSPFYUVWFCBF-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)(C)C(=O)O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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