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114648-67-8 | Methanone, 1H-indol-2-yl-1H-indol-3-yl-
CAS No: 114648-67-8 Catalog No: AG000EYC MDL No:MFCD05148927
Product Description
Catalog Number:
AG000EYC
Chemical Name:
Methanone, 1H-indol-2-yl-1H-indol-3-yl-
CAS Number:
114648-67-8
Molecular Formula:
C17H12N2O
Molecular Weight:
260.2900
MDL Number:
MFCD05148927
IUPAC Name:
1H-indol-2-yl(1H-indol-3-yl)methanone
InChI:
InChI=1S/C17H12N2O/c20-17(13-10-18-15-8-4-2-6-12(13)15)16-9-11-5-1-3-7-14(11)19-16/h1-10,18-19H
InChI Key:
ZYCSHQBGKAGFMY-UHFFFAOYSA-N
SMILES:
O=C(c1c[nH]c2c1cccc2)c1cc2c([nH]1)cccc2
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.095g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.296g/mol
Monoisotopic Mass:
260.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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