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Home > Indoles and Oxindole > 114479-12-8
114479-12-8 | 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-
CAS No: 114479-12-8 Catalog No: AG000EIC MDL No:
Product Description
Catalog Number:
AG000EIC
Chemical Name:
3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-
CAS Number:
114479-12-8
Molecular Formula:
C18H19NO
Molecular Weight:
265.3496
IUPAC Name:
2-(2-methoxy-5-methylphenyl)-3,3-dimethylindole
InChI:
InChI=1S/C18H19NO/c1-12-9-10-16(20-4)13(11-12)17-18(2,3)14-7-5-6-8-15(14)19-17/h5-11H,1-4H3
InChI Key:
RWCDZKHBJGXNQH-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C1=Nc2c(C1(C)C)cccc2)C
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.356g/mol
Monoisotopic Mass:
265.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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