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1147557-75-2 | Benzenamine, 2,5-difluoro-4-(methylsulfonyl)-
CAS No: 1147557-75-2 Catalog No: AG000F61 MDL No:MFCD20259003
Product Description
Catalog Number:
AG000F61
Chemical Name:
Benzenamine, 2,5-difluoro-4-(methylsulfonyl)-
CAS Number:
1147557-75-2
Molecular Formula:
C7H7F2NO2S
Molecular Weight:
207.1978
MDL Number:
MFCD20259003
IUPAC Name:
2,5-difluoro-4-methylsulfonylaniline
InChI:
InChI=1S/C7H7F2NO2S/c1-13(11,12)7-3-4(8)6(10)2-5(7)9/h2-3H,10H2,1H3
InChI Key:
YFHKCMZYVVBUFC-UHFFFAOYSA-N
SMILES:
Fc1cc(c(cc1N)F)S(=O)(=O)C
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.017g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.195g/mol
Monoisotopic Mass:
207.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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