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1707580-57-1 | N-(Piperidin-4-yl)-4-(trifluoromethyl)benzamide hydrochloride
CAS No: 1707580-57-1 Catalog No: AG01F6J1 MDL No:
Product Description
Catalog Number:
AG01F6J1
Chemical Name:
N-(Piperidin-4-yl)-4-(trifluoromethyl)benzamide hydrochloride
CAS Number:
1707580-57-1
Molecular Formula:
C13H16ClF3N2O
Molecular Weight:
308.7271
IUPAC Name:
N-piperidin-4-yl-4-(trifluoromethyl)benzamide;hydrochloride
InChI:
InChI=1S/C13H15F3N2O.ClH/c14-13(15,16)10-3-1-9(2-4-10)12(19)18-11-5-7-17-8-6-11;/h1-4,11,17H,5-8H2,(H,18,19);1H
InChI Key:
WCBFNLYKVOSLQF-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C(F)(F)F)NC1CCNCC1.Cl
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
308.729g/mol
Monoisotopic Mass:
308.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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