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Home > Indoles and Oxindole > 830347-27-8
830347-27-8 | Cyclopent[b]indol-3(2H)-one, 7-acetyl-1,4-dihydro-6-methyl-
CAS No: 830347-27-8 Catalog No: AG0052O2 MDL No:
Product Description
Catalog Number:
AG0052O2
Chemical Name:
Cyclopent[b]indol-3(2H)-one, 7-acetyl-1,4-dihydro-6-methyl-
CAS Number:
830347-27-8
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
IUPAC Name:
7-acetyl-6-methyl-2,4-dihydro-1H-cyclopenta[b]indol-3-one
InChI:
InChI=1S/C14H13NO2/c1-7-5-12-11(6-10(7)8(2)16)9-3-4-13(17)14(9)15-12/h5-6,15H,3-4H2,1-2H3
InChI Key:
HSDGMOOAOOGGFY-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc2c(cc1C)[nH]c1c2CCC1=O
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.095g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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