Home Other Building Blocks 2-(piperidin-1-yl)benzoic acid hydrochloride

2-(piperidin-1-yl)benzoic acid hydrochloride

CAS No.:
939964-55-3
Catalog Number:
AG01BA0V
Molecular Formula:
C12H16ClNO2
Molecular Weight:
241.7139
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Product Description
Catalog Number:
AG01BA0V
Chemical Name:
2-(piperidin-1-yl)benzoic acid hydrochloride
CAS Number:
939964-55-3
Molecular Formula:
C12H16ClNO2
Molecular Weight:
241.7139
MDL Number:
MFCD28397467
IUPAC Name:
2-piperidin-1-ylbenzoic acid;hydrochloride
InChI:
InChI=1S/C12H15NO2.ClH/c14-12(15)10-6-2-3-7-11(10)13-8-4-1-5-9-13;/h2-3,6-7H,1,4-5,8-9H2,(H,14,15);1H
InChI Key:
LHQNMRHFDNVPOO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1N1CCCCC1.Cl
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.087g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.715g/mol
Monoisotopic Mass:
241.087g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties