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Home > Indoles and Oxindole > 74794-89-1
74794-89-1 | 1H-Indole, 4,6-dimethoxy-2-phenyl-
CAS No: 74794-89-1 Catalog No: AG00598P MDL No:
Product Description
Catalog Number:
AG00598P
Chemical Name:
1H-Indole, 4,6-dimethoxy-2-phenyl-
CAS Number:
74794-89-1
Molecular Formula:
C16H15NO2
Molecular Weight:
253.2958
IUPAC Name:
4,6-dimethoxy-2-phenyl-1H-indole
InChI:
InChI=1S/C16H15NO2/c1-18-12-8-15-13(16(9-12)19-2)10-14(17-15)11-6-4-3-5-7-11/h3-10,17H,1-2H3
InChI Key:
VIQJORCARYYQKB-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc2c1cc([nH]2)c1ccccc1
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.11g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.301g/mol
Monoisotopic Mass:
253.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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