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Home > Indoles and Oxindole > 95275-68-6
95275-68-6 | 2-Butanone, 4-(2-phenyl-1H-indol-3-yl)-
CAS No: 95275-68-6 Catalog No: AG0065OF MDL No:
Product Description
Catalog Number:
AG0065OF
Chemical Name:
2-Butanone, 4-(2-phenyl-1H-indol-3-yl)-
CAS Number:
95275-68-6
Molecular Formula:
C18H17NO
Molecular Weight:
263.3337
IUPAC Name:
4-(2-phenyl-1H-indol-3-yl)butan-2-one
InChI:
InChI=1S/C18H17NO/c1-13(20)11-12-16-15-9-5-6-10-17(15)19-18(16)14-7-3-2-4-8-14/h2-10,19H,11-12H2,1H3
InChI Key:
DGIPYGNGGQPNHB-UHFFFAOYSA-N
SMILES:
CC(=O)CCc1c([nH]c2c1cccc2)c1ccccc1
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.34g/mol
Monoisotopic Mass:
263.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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