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116584-62-4 | Ethanone, 1-(5-amino-2,3-dihydro-3,3-dimethyl-1H-indol-1-yl)-
CAS No: 116584-62-4 Catalog No: AG000CTK MDL No:
Product Description
Catalog Number:
AG000CTK
Chemical Name:
Ethanone, 1-(5-amino-2,3-dihydro-3,3-dimethyl-1H-indol-1-yl)-
CAS Number:
116584-62-4
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
IUPAC Name:
1-(5-amino-3,3-dimethyl-2H-indol-1-yl)ethanone
InChI:
InChI=1S/C12H16N2O/c1-8(15)14-7-12(2,3)10-6-9(13)4-5-11(10)14/h4-6H,7,13H2,1-3H3
InChI Key:
OUPTXVRWGFOOOG-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)C(C)(C)CN2C(=O)C
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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