3-(Hydroxyacetyl)indole - CAS 2400-51-3
Catalog: |
BB018283 |
Product Name: |
3-(Hydroxyacetyl)indole |
CAS: |
2400-51-3 |
Synonyms: |
3-Glyceroindole; 2-Hydroxy-1-(3-indolyl)ethanone; Hydroxymethyl indol-3-yl ketone |
IUPAC Name: | 2-hydroxy-1-(1H-indol-3-yl)ethanone |
Description: | 2-Hydroxy-1-(3-indolyl)ethanone (CAS# 2400-51-3) is a useful research chemical. |
Molecular Weight: | 175.18 |
Molecular Formula: | C10H9NO2 |
Canonical SMILES: | C1=CC=C2C(=C1)C(=CN2)C(=O)CO |
InChI: | InChI=1S/C10H9NO2/c12-6-10(13)8-5-11-9-4-2-1-3-7(8)9/h1-5,11-12H,6H2 |
InChI Key: | IBLZDDPFMAFWKP-UHFFFAOYSA-N |
Boiling Point: | 399.1°C at 760 mmHg |
Melting Point: | 173 - 174 °C |
Purity: | 98% |
Density: | 1.338 g/cm3 |
Appearance: | Solid |
LogP: | 1.34290 |
Publication Number | Title | Priority Date |
US-2020276100-A1 | Photoprotective compositions containing malassezia-derived compounds and/or chemical analogs thereof | 20181008 |
TW-202034913-A | Photoprotective compositions containing malassezia-derived compounds and/or chemical analogs thereof | 20181008 |
TW-202023522-A | Photoprotective compositions containing malassezia-derived compounds and/or chemical analogs thereof | 20180824 |
TW-201946621-A | Anti-light composition containing malassezia-derived compound and / or chemical analogue thereof | 20180412 |
US-2017066712-A1 | Novel molecules that selectively inhibit histone deacetylase 6 relative to histone deacetylase | 20111003 |
PMID | Publication Date | Title | Journal |
22990456 | 20120918 | Antitrypanosomal alkaloids from the marine bacterium Bacillus pumilus | Molecules (Basel, Switzerland) |
21036050 | 20101201 | Structure and biological evaluation of novel cytotoxic sterol glycosides from the marine red alga Peyssonnelia sp | Bioorganic & medicinal chemistry |
19842066 | 20100901 | Bioactive secondary metabolites from a new terrestrial Streptomyces sp. TN262 | Applied biochemistry and biotechnology |
16724845 | 20060501 | Antineoplastic Agents. 554. The manitoba bacterium Streptomyces sp | Journal of natural products |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 175.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.06332853 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 53.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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