Home Carboxys 4-Piperidinecarboxylic acid, 2-(trifluoromethyl)-, hydrochloride (1:1)

4-Piperidinecarboxylic acid, 2-(trifluoromethyl)-, hydrochloride (1:1)

CAS No.:
2007919-93-7
Catalog Number:
AG002D0L
Molecular Formula:
C7H11ClF3NO2
Molecular Weight:
233.6159
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Product Description
Catalog Number:
AG002D0L
Chemical Name:
4-Piperidinecarboxylic acid, 2-(trifluoromethyl)-, hydrochloride (1:1)
CAS Number:
2007919-93-7
Molecular Formula:
C7H11ClF3NO2
Molecular Weight:
233.6159
MDL Number:
MFCD29918541
IUPAC Name:
2-(trifluoromethyl)piperidine-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H10F3NO2.ClH/c8-7(9,10)5-3-4(6(12)13)1-2-11-5;/h4-5,11H,1-3H2,(H,12,13);1H
InChI Key:
MSUATQFDGCXRGM-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCNC(C1)C(F)(F)F.Cl
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.043g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
233.615g/mol
Monoisotopic Mass:
233.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties