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Home > Indoles and Oxindole > 16078-32-3
16078-32-3 | 1H-Indole, 1-acetyl-2,3-dihydro-3,3-dimethyl-
CAS No: 16078-32-3 Catalog No: AG00HYM7 MDL No:MFCD27945616
Product Description
Catalog Number:
AG00HYM7
Chemical Name:
1H-Indole, 1-acetyl-2,3-dihydro-3,3-dimethyl-
CAS Number:
16078-32-3
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD27945616
IUPAC Name:
1-(3,3-dimethyl-2H-indol-1-yl)ethanone
InChI:
InChI=1S/C12H15NO/c1-9(14)13-8-12(2,3)10-6-4-5-7-11(10)13/h4-7H,8H2,1-3H3
InChI Key:
PYWPWPPRAYOLIB-UHFFFAOYSA-N
SMILES:
CC(=O)N1CC(c2c1cccc2)(C)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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