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2007921-17-5 | 1H-Indol-6-amine, 3-(trifluoromethyl)-, hydrochloride (1:1)
CAS No: 2007921-17-5 Catalog No: AG002D0F MDL No:
Product Description
Catalog Number:
AG002D0F
Chemical Name:
1H-Indol-6-amine, 3-(trifluoromethyl)-, hydrochloride (1:1)
CAS Number:
2007921-17-5
Molecular Formula:
C9H8ClF3N2
Molecular Weight:
236.6214
IUPAC Name:
3-(trifluoromethyl)-1H-indol-6-amine;hydrochloride
InChI:
InChI=1S/C9H7F3N2.ClH/c10-9(11,12)7-4-14-8-3-5(13)1-2-6(7)8;/h1-4,14H,13H2;1H
InChI Key:
WYUYNEXRVDJIDX-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)[nH]cc2C(F)(F)F.Cl
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.033g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
236.622g/mol
Monoisotopic Mass:
236.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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