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117616-09-8

117616-09-8 | 1H-Indole, 5-methoxy-1-methyl-2-phenyl-

CAS No: 117616-09-8 Catalog No: AG000HJ9 MDL No:

Product Description

Catalog Number:
AG000HJ9
Chemical Name:
1H-Indole, 5-methoxy-1-methyl-2-phenyl-
CAS Number:
117616-09-8
Molecular Formula:
C16H15NO
Molecular Weight:
237.2964
IUPAC Name:
5-methoxy-1-methyl-2-phenylindole
InChI:
InChI=1S/C16H15NO/c1-17-15-9-8-14(18-2)10-13(15)11-16(17)12-6-4-3-5-7-12/h3-11H,1-2H3
InChI Key:
XFFCYCXDAVKKBW-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(n2C)c1ccccc1

Properties

Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.115g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.302g/mol
Monoisotopic Mass:
237.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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