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143879-78-1 | Benzonitrile, 3-amino-2,6-difluoro-
CAS No: 143879-78-1 Catalog No: AG001IJL MDL No:MFCD00120310
Product Description
Catalog Number:
AG001IJL
Chemical Name:
Benzonitrile, 3-amino-2,6-difluoro-
CAS Number:
143879-78-1
Molecular Formula:
C7H4F2N2
Molecular Weight:
154.1169
MDL Number:
MFCD00120310
IUPAC Name:
3-amino-2,6-difluorobenzonitrile
InChI:
InChI=1S/C7H4F2N2/c8-5-1-2-6(11)7(9)4(5)3-10/h1-2H,11H2
InChI Key:
RXLFDOQOCRNACG-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)ccc(c1F)N
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.034g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.12g/mol
Monoisotopic Mass:
154.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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