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Home > Indoles and Oxindole > 1693676-76-4
1693676-76-4 | 5-methoxy-3-(propan-2-yl)-1H-indole
CAS No: 1693676-76-4 Catalog No: AG01BIA6 MDL No:MFCD29489913
Product Description
Catalog Number:
AG01BIA6
Chemical Name:
5-methoxy-3-(propan-2-yl)-1H-indole
CAS Number:
1693676-76-4
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD29489913
IUPAC Name:
5-methoxy-3-propan-2-yl-1H-indole
InChI:
InChI=1S/C12H15NO/c1-8(2)11-7-13-12-5-4-9(14-3)6-10(11)12/h4-8,13H,1-3H3
InChI Key:
VJPLFAZYTXFALU-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(c[nH]2)C(C)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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