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123973-31-9 | Benzenamine, 2-chloro-6-fluoro-4-(trifluoromethyl)-
CAS No: 123973-31-9 Catalog No: AG000LAN MDL No:
Product Description
Catalog Number:
AG000LAN
Chemical Name:
Benzenamine, 2-chloro-6-fluoro-4-(trifluoromethyl)-
CAS Number:
123973-31-9
Molecular Formula:
C7H4ClF4N
Molecular Weight:
213.5600
IUPAC Name:
2-chloro-6-fluoro-4-(trifluoromethyl)aniline
InChI:
InChI=1S/C7H4ClF4N/c8-4-1-3(7(10,11)12)2-5(9)6(4)13/h1-2H,13H2
InChI Key:
AIBDHZJCYMSHOK-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1N)Cl)C(F)(F)F
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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