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304458-50-2 | 4-Chloro-N-[(pentafluorophenyl)methyl]benzamide
CAS No: 304458-50-2 Catalog No: AG01F9XD MDL No:
Product Description
Catalog Number:
AG01F9XD
Chemical Name:
4-Chloro-N-[(pentafluorophenyl)methyl]benzamide
CAS Number:
304458-50-2
Molecular Formula:
C14H7ClF5NO
Molecular Weight:
335.6565
IUPAC Name:
4-chloro-N-[(2,3,4,5,6-pentafluorophenyl)methyl]benzamide
InChI:
InChI=1S/C14H7ClF5NO/c15-7-3-1-6(2-4-7)14(22)21-5-8-9(16)11(18)13(20)12(19)10(8)17/h1-4H,5H2,(H,21,22)
InChI Key:
AZSQFUHIDFTYPO-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(=O)NCc1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.014g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.658g/mol
Monoisotopic Mass:
335.014g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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