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220970-48-9 | Cyclopentanone, 3-(1-methyl-1H-indol-3-yl)-
CAS No: 220970-48-9 Catalog No: AG00709M MDL No:
Product Description
Catalog Number:
AG00709M
Chemical Name:
Cyclopentanone, 3-(1-methyl-1H-indol-3-yl)-
CAS Number:
220970-48-9
Molecular Formula:
C14H15NO
Molecular Weight:
213.2750
IUPAC Name:
3-(1-methylindol-3-yl)cyclopentan-1-one
InChI:
InChI=1S/C14H15NO/c1-15-9-13(10-6-7-11(16)8-10)12-4-2-3-5-14(12)15/h2-5,9-10H,6-8H2,1H3
InChI Key:
ZDAWTASYTNCCCU-UHFFFAOYSA-N
SMILES:
O=C1CCC(C1)c1cn(c2c1cccc2)C
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.115g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.28g/mol
Monoisotopic Mass:
213.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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