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Home > Indoles and Oxindole > 15069-79-1
15069-79-1 | 5,6-Diacetoxyindole
CAS No: 15069-79-1 Catalog No: AG003M9F MDL No:MFCD00152051
Product Description
Catalog Number:
AG003M9F
Chemical Name:
5,6-Diacetoxyindole
CAS Number:
15069-79-1
Molecular Formula:
C12H11NO4
Molecular Weight:
233.2200
MDL Number:
MFCD00152051
IUPAC Name:
(6-acetyloxy-1H-indol-5-yl) acetate
InChI:
InChI=1S/C12H11NO4/c1-7(14)16-11-5-9-3-4-13-10(9)6-12(11)17-8(2)15/h3-6,13H,1-2H3
InChI Key:
NTOLUQGMBCPVOZ-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1cc2[nH]ccc2cc1OC(=O)C
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.069g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.223g/mol
Monoisotopic Mass:
233.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Melanin precursor 5,6-dihydroxyindol: protective effects and cytotoxicity on retinal cells in vitro and in vivo. | Toxicologic pathology 20071201 |
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