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Home > Indoles and Oxindole > 86111-15-1
86111-15-1 | 1H-Indol-6-ol, 1-ethyl-2-(4-hydroxyphenyl)-3-methyl-
CAS No: 86111-15-1 Catalog No: AG004TXE MDL No:
Product Description
Catalog Number:
AG004TXE
Chemical Name:
1H-Indol-6-ol, 1-ethyl-2-(4-hydroxyphenyl)-3-methyl-
CAS Number:
86111-15-1
Molecular Formula:
C17H17NO2
Molecular Weight:
267.3224
IUPAC Name:
1-ethyl-2-(4-hydroxyphenyl)-3-methylindol-6-ol
InChI:
InChI=1S/C17H17NO2/c1-3-18-16-10-14(20)8-9-15(16)11(2)17(18)12-4-6-13(19)7-5-12/h4-10,19-20H,3H2,1-2H3
InChI Key:
NZOXLJHRDLTJCP-UHFFFAOYSA-N
SMILES:
CCn1c(c2ccc(cc2)O)c(c2c1cc(O)cc2)C
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.126g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
267.328g/mol
Monoisotopic Mass:
267.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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