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Home > Indoles and Oxindole > 13228-36-9
13228-36-9 | 1H-Indole, 5-methyl-2-phenyl-
CAS No: 13228-36-9 Catalog No: AG0010GO MDL No:
Product Description
Catalog Number:
AG0010GO
Chemical Name:
1H-Indole, 5-methyl-2-phenyl-
CAS Number:
13228-36-9
Molecular Formula:
C15H13N
Molecular Weight:
207.2704
IUPAC Name:
5-methyl-2-phenyl-1H-indole
InChI:
InChI=1S/C15H13N/c1-11-7-8-14-13(9-11)10-15(16-14)12-5-3-2-4-6-12/h2-10,16H,1H3
InChI Key:
JPFTUUXPCFNLIX-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)cc([nH]2)c1ccccc1
NSC Number:
101085
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.276g/mol
Monoisotopic Mass:
207.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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