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Home > Indoles and Oxindole > 7253-48-7
7253-48-7 | 3-(1,2-dimethyl-1h-indol-3-yl)cyclopentanone
CAS No: 7253-48-7 Catalog No: AG005GF6 MDL No:
Product Description
Catalog Number:
AG005GF6
Chemical Name:
3-(1,2-dimethyl-1h-indol-3-yl)cyclopentanone
CAS Number:
7253-48-7
Molecular Formula:
C15H17NO
Molecular Weight:
227.3016
IUPAC Name:
3-(1,2-dimethylindol-3-yl)cyclopentan-1-one
InChI:
InChI=1S/C15H17NO/c1-10-15(11-7-8-12(17)9-11)13-5-3-4-6-14(13)16(10)2/h3-6,11H,7-9H2,1-2H3
InChI Key:
DBXKLIDPGUGJOZ-UHFFFAOYSA-N
SMILES:
O=C1CCC(C1)c1c(C)n(c2c1cccc2)C
NSC Number:
52369
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.131g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.307g/mol
Monoisotopic Mass:
227.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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