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Home > Indoles and Oxindole > 100487-72-7
100487-72-7 | 2H-Indol-2-one, 1,3-dihydro-4,5-dimethyl-
CAS No: 100487-72-7 Catalog No: AG00023F MDL No:
Product Description
Catalog Number:
AG00023F
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-4,5-dimethyl-
CAS Number:
100487-72-7
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
4,5-dimethyl-1,3-dihydroindol-2-one
InChI:
InChI=1S/C10H11NO/c1-6-3-4-9-8(7(6)2)5-10(12)11-9/h3-4H,5H2,1-2H3,(H,11,12)
InChI Key:
DCWSRBDYLSWXIS-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(C)c(cc2)C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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