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Home > Indoles and Oxindole > 1167055-81-3
1167055-81-3 | 1H-Indole, 7-Methoxy-6-(1-Methylethyl)-
CAS No: 1167055-81-3 Catalog No: AG000D1U MDL No:
Product Description
Catalog Number:
AG000D1U
Chemical Name:
1H-Indole, 7-Methoxy-6-(1-Methylethyl)-
CAS Number:
1167055-81-3
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
IUPAC Name:
7-methoxy-6-propan-2-yl-1H-indole
InChI:
InChI=1S/C12H15NO/c1-8(2)10-5-4-9-6-7-13-11(9)12(10)14-3/h4-8,13H,1-3H3
InChI Key:
DHWVFZUJBMMLAN-UHFFFAOYSA-N
SMILES:
COc1c(ccc2c1[nH]cc2)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:
3.1
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