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Home > Indoles and Oxindole > 17591-06-9
17591-06-9 | 1H-Indole, 5-methoxy-1,2-dimethyl-
CAS No: 17591-06-9 Catalog No: AG0021B7 MDL No:MFCD00033489
Product Description
Catalog Number:
AG0021B7
Chemical Name:
1H-Indole, 5-methoxy-1,2-dimethyl-
CAS Number:
17591-06-9
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD00033489
IUPAC Name:
5-methoxy-1,2-dimethylindole
InChI:
InChI=1S/C11H13NO/c1-8-6-9-7-10(13-3)4-5-11(9)12(8)2/h4-7H,1-3H3
InChI Key:
FODAUNMFUIXBBO-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(n2C)C
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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