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1735-89-3 | 2H-Indol-2-one, 1,3-dihydro-6-(trifluoromethyl)-
CAS No: 1735-89-3 Catalog No: AG001YZO MDL No:MFCD01075220
Product Description
Catalog Number:
AG001YZO
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-6-(trifluoromethyl)-
CAS Number:
1735-89-3
Molecular Formula:
C9H6F3NO
Molecular Weight:
201.1452
MDL Number:
MFCD01075220
IUPAC Name:
6-(trifluoromethyl)-1,3-dihydroindol-2-one
InChI:
InChI=1S/C9H6F3NO/c10-9(11,12)6-2-1-5-3-8(14)13-7(5)4-6/h1-2,4H,3H2,(H,13,14)
InChI Key:
LZPKWQOLOCLSBO-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(N1)cc(cc2)C(F)(F)F
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.148g/mol
Monoisotopic Mass:
201.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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