Ketone, 1-ethyl-3-indolyl hydroxymethyl
TL;DR: Ketone, 1-ethyl-3-indolyl hydroxymethyl (CAS 38692-98-7) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-ethylindol-3-yl)-2-hydroxyethanone
Also Known As: 1-Ethyl-3-(hydroxyacetyl)indole, 1-ethyl-3-hydroxy-acetylindole, KETONE, 1-ETHYL-3-INDOLYL HYDROXYMETHYL, 5-21-12-00355 (Beilstein Handbook Reference), 1-(1-ethylindol-3-yl)-2-hydroxyethanone
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 42.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 38692-98-7 |
|---|---|
| SMILES | CCN1C=C(C2=CC=CC=C21)C(=O)CO |
| InChIKey | YYJBEMIHSBFPNX-UHFFFAOYSA-N |
Product Overview
Ketone, 1-ethyl-3-indolyl hydroxymethyl (CAS 38692-98-7), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: 1-(1-ethylindol-3-yl)-2-hydroxyethanone.
Chemical Property Profile of Ketone, 1-ethyl-3-indolyl hydroxymethyl
Property Insights of Ketone, 1-ethyl-3-indolyl hydroxymethyl
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ketone, 1-ethyl-3-indolyl hydroxymethyl. With a topological polar surface area (TPSA) of 42.2 Ų, Ketone, 1-ethyl-3-indolyl hydroxymethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketone, 1-ethyl-3-indolyl hydroxymethyl has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ketone, 1-ethyl-3-indolyl hydroxymethyl?
The CAS number of Ketone, 1-ethyl-3-indolyl hydroxymethyl is 38692-98-7.
What is the molecular formula of Ketone, 1-ethyl-3-indolyl hydroxymethyl?
The molecular formula of Ketone, 1-ethyl-3-indolyl hydroxymethyl is C12H13NO2.
What is the molecular weight of Ketone, 1-ethyl-3-indolyl hydroxymethyl?
The molecular weight of Ketone, 1-ethyl-3-indolyl hydroxymethyl is 203.09 g/mol.
Where can I buy Ketone, 1-ethyl-3-indolyl hydroxymethyl?
You can request a quote for Ketone, 1-ethyl-3-indolyl hydroxymethyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketone, 1-ethyl-3-indolyl hydroxymethyl?
Yes, KEHONG BIO provides custom synthesis services for Ketone, 1-ethyl-3-indolyl hydroxymethyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.