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Home > Indoles and Oxindole > 169057-11-8
169057-11-8 | 2-Propen-1-one, 1,3-di-1H-indol-3-yl-
CAS No: 169057-11-8 Catalog No: AG007AXR MDL No:
Product Description
Catalog Number:
AG007AXR
Chemical Name:
2-Propen-1-one, 1,3-di-1H-indol-3-yl-
CAS Number:
169057-11-8
Molecular Formula:
C19H14N2O
Molecular Weight:
286.3273
IUPAC Name:
1,3-bis(1H-indol-3-yl)prop-2-en-1-one
InChI:
InChI=1S/C19H14N2O/c22-19(16-12-21-18-8-4-2-6-15(16)18)10-9-13-11-20-17-7-3-1-5-14(13)17/h1-12,20-21H
InChI Key:
QXTGQLSOKNQOOZ-UHFFFAOYSA-N
SMILES:
O=C(c1c[nH]c2c1cccc2)C=Cc1c[nH]c2c1cccc2
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.111g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.334g/mol
Monoisotopic Mass:
286.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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