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14791-78-7 | 1,4-Benzenediamine, 2-fluoro-
CAS No: 14791-78-7 Catalog No: AG001FA6 MDL No:MFCD09955618
Product Description
Catalog Number:
AG001FA6
Chemical Name:
1,4-Benzenediamine, 2-fluoro-
CAS Number:
14791-78-7
Molecular Formula:
C6H7FN2
Molecular Weight:
126.1316
MDL Number:
MFCD09955618
IUPAC Name:
2-fluorobenzene-1,4-diamine
InChI:
InChI=1S/C6H7FN2/c7-5-3-4(8)1-2-6(5)9/h1-3H,8-9H2
InChI Key:
FXFTWEVIIHVHDS-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)F)N
NSC Number:
402988
Properties
Complexity:
97.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.059g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
126.134g/mol
Monoisotopic Mass:
126.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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