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Home > Indoles and Oxindole > 164082-79-5
164082-79-5 | 1H-Indole, 2-ethyl-4-methoxy-
CAS No: 164082-79-5 Catalog No: AG001ULX MDL No:MFCD09833268
Product Description
Catalog Number:
AG001ULX
Chemical Name:
1H-Indole, 2-ethyl-4-methoxy-
CAS Number:
164082-79-5
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD09833268
IUPAC Name:
2-ethyl-4-methoxy-1H-indole
InChI:
InChI=1S/C11H13NO/c1-3-8-7-9-10(12-8)5-4-6-11(9)13-2/h4-7,12H,3H2,1-2H3
InChI Key:
QNRDJVAPLVTDJJ-UHFFFAOYSA-N
SMILES:
CCc1cc2c([nH]1)cccc2OC
Properties
Complexity:
172
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:
1
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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