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151276-13-0 | Benzenamine, 3-chloro-5-(trifluoromethoxy)-
CAS No: 151276-13-0 Catalog No: AG001N7V MDL No:MFCD09832245
Product Description
Catalog Number:
AG001N7V
Chemical Name:
Benzenamine, 3-chloro-5-(trifluoromethoxy)-
CAS Number:
151276-13-0
Molecular Formula:
C7H5ClF3NO
Molecular Weight:
211.5689
MDL Number:
MFCD09832245
IUPAC Name:
3-chloro-5-(trifluoromethoxy)aniline
InChI:
InChI=1S/C7H5ClF3NO/c8-4-1-5(12)3-6(2-4)13-7(9,10)11/h1-3H,12H2
InChI Key:
LGCOAKFQLUXQAB-UHFFFAOYSA-N
SMILES:
Nc1cc(cc(c1)Cl)OC(F)(F)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.001g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.568g/mol
Monoisotopic Mass:
211.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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