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205756-35-0 | Ethanone, 1-(2-amino-5-methylphenyl)-2,2,2-trifluoro-
CAS No: 205756-35-0 Catalog No: AG002ABS MDL No:MFCD13172936
Product Description
Catalog Number:
AG002ABS
Chemical Name:
Ethanone, 1-(2-amino-5-methylphenyl)-2,2,2-trifluoro-
CAS Number:
205756-35-0
Molecular Formula:
C9H8F3NO
Molecular Weight:
203.1611
MDL Number:
MFCD13172936
IUPAC Name:
1-(2-amino-5-methylphenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C9H8F3NO/c1-5-2-3-7(13)6(4-5)8(14)9(10,11)12/h2-4H,13H2,1H3
InChI Key:
ATASQYGAUFQEEY-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1cc(C)ccc1N
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.056g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.164g/mol
Monoisotopic Mass:
203.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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