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Home > Fluorides > 1016804-69-5
1016804-69-5 | Benzamide, N-(2-cyanophenyl)-3,4-difluoro-
CAS No: 1016804-69-5 Catalog No: AG00056U MDL No:MFCD09948866
Product Description
Catalog Number:
AG00056U
Chemical Name:
Benzamide, N-(2-cyanophenyl)-3,4-difluoro-
CAS Number:
1016804-69-5
Molecular Formula:
C14H8F2N2O
Molecular Weight:
258.2229
MDL Number:
MFCD09948866
IUPAC Name:
N-(2-cyanophenyl)-3,4-difluorobenzamide
InChI:
InChI=1S/C14H8F2N2O/c15-11-6-5-9(7-12(11)16)14(19)18-13-4-2-1-3-10(13)8-17/h1-7H,(H,18,19)
InChI Key:
PBULRHDQXUTYML-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1NC(=O)c1ccc(c(c1)F)F
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.06g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.228g/mol
Monoisotopic Mass:
258.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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