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1397196-68-7 | Acetamide, 2-chloro-N-(3-pyridinylmethyl)-N-[3-(trifluoromethyl)phenyl]-
CAS No: 1397196-68-7 Catalog No: AG001BK7 MDL No:
Product Description
Catalog Number:
AG001BK7
Chemical Name:
Acetamide, 2-chloro-N-(3-pyridinylmethyl)-N-[3-(trifluoromethyl)phenyl]-
CAS Number:
1397196-68-7
Molecular Formula:
C15H12ClF3N2O
Molecular Weight:
328.7168
IUPAC Name:
2-chloro-N-(pyridin-3-ylmethyl)-N-[3-(trifluoromethyl)phenyl]acetamide
InChI:
InChI=1S/C15H12ClF3N2O/c16-8-14(22)21(10-11-3-2-6-20-9-11)13-5-1-4-12(7-13)15(17,18)19/h1-7,9H,8,10H2
InChI Key:
VCOUEVHOTIWRND-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(c1cccc(c1)C(F)(F)F)Cc1cccnc1
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.059g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.719g/mol
Monoisotopic Mass:
328.059g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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