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Home > Indoles and Oxindole > 86111-04-8
86111-04-8 | 1H-Indol-5-ol, 1-ethyl-2-(4-hydroxyphenyl)-
CAS No: 86111-04-8 Catalog No: AG004TXF MDL No:
Product Description
Catalog Number:
AG004TXF
Chemical Name:
1H-Indol-5-ol, 1-ethyl-2-(4-hydroxyphenyl)-
CAS Number:
86111-04-8
Molecular Formula:
C16H15NO2
Molecular Weight:
253.2958
IUPAC Name:
1-ethyl-2-(4-hydroxyphenyl)indol-5-ol
InChI:
InChI=1S/C16H15NO2/c1-2-17-15-8-7-14(19)9-12(15)10-16(17)11-3-5-13(18)6-4-11/h3-10,18-19H,2H2,1H3
InChI Key:
GTQIIXFHYSFCDS-UHFFFAOYSA-N
SMILES:
CCn1c(cc2c1ccc(c2)O)c1ccc(cc1)O
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.11g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.301g/mol
Monoisotopic Mass:
253.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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