Home Carboxys 1-Benzylpiperidine-3-carboxylic acid hydrochloride

1-Benzylpiperidine-3-carboxylic acid hydrochloride

CAS No.:
50585-92-7
Catalog Number:
AG006XUZ
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
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Product Description
Catalog Number:
AG006XUZ
Chemical Name:
1-Benzylpiperidine-3-carboxylic acid hydrochloride
CAS Number:
50585-92-7
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
MDL Number:
MFCD06799952
IUPAC Name:
1-benzylpiperidine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C13H17NO2.ClH/c15-13(16)12-7-4-8-14(10-12)9-11-5-2-1-3-6-11;/h1-3,5-6,12H,4,7-10H2,(H,15,16);1H
InChI Key:
GDQLYIBFDWPBDT-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCN(C1)Cc1ccccc1.Cl
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.103g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.742g/mol
Monoisotopic Mass:
255.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties