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Home > Indoles and Oxindole > 113342-39-5
113342-39-5 | 7H-Indol-7-one, 1,4,5,6-tetrahydro-1-methyl-
CAS No: 113342-39-5 Catalog No: AG007SL6 MDL No:
Product Description
Catalog Number:
AG007SL6
Chemical Name:
7H-Indol-7-one, 1,4,5,6-tetrahydro-1-methyl-
CAS Number:
113342-39-5
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
IUPAC Name:
1-methyl-5,6-dihydro-4H-indol-7-one
InChI:
InChI=1S/C9H11NO/c1-10-6-5-7-3-2-4-8(11)9(7)10/h5-6H,2-4H2,1H3
InChI Key:
PRHGWZFYDVSVJU-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1n(C)cc2
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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