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125508-25-0 | Benzenamine, 2-chloro-4-fluoro-5-(trifluoromethyl)-
CAS No: 125508-25-0 Catalog No: AG000NR4 MDL No:
Product Description
Catalog Number:
AG000NR4
Chemical Name:
Benzenamine, 2-chloro-4-fluoro-5-(trifluoromethyl)-
CAS Number:
125508-25-0
Molecular Formula:
C7H4ClF4N
Molecular Weight:
213.5600
IUPAC Name:
2-chloro-4-fluoro-5-(trifluoromethyl)aniline
InChI:
InChI=1S/C7H4ClF4N/c8-4-2-5(9)3(1-6(4)13)7(10,11)12/h1-2H,13H2
InChI Key:
WAHMPPLIGCOKGX-UHFFFAOYSA-N
SMILES:
Fc1cc(Cl)c(cc1C(F)(F)F)N
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.997g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.56g/mol
Monoisotopic Mass:
212.997g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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