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Home > Indoles and Oxindole > 167558-64-7
167558-64-7 | 1H-Indole, 3-methyl-1-(4-methylphenyl)-
CAS No: 167558-64-7 Catalog No: AG001XGO MDL No:
Product Description
Catalog Number:
AG001XGO
Chemical Name:
1H-Indole, 3-methyl-1-(4-methylphenyl)-
CAS Number:
167558-64-7
Molecular Formula:
C16H15N
Molecular Weight:
221.2970
IUPAC Name:
3-methyl-1-(4-methylphenyl)indole
InChI:
InChI=1S/C16H15N/c1-12-7-9-14(10-8-12)17-11-13(2)15-5-3-4-6-16(15)17/h3-11H,1-2H3
InChI Key:
BSPUEDYRGOEXSR-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)n1cc(c2c1cccc2)C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.303g/mol
Monoisotopic Mass:
221.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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