乙醇酸(3-吲哚基羰基)甲酯
TL;DR: 乙醇酸(3-吲哚基羰基)甲酯 (CAS 38693-04-8) is a chemical compound with molecular formula C12H11NO4 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙醇酸(3-吲哚基羰基)甲酯
[2-(1H-indol-3-yl)-2-oxoethyl] 2-hydroxyacetate
Also Known As: 3-(Hydroxyacetoxyacetyl)indole, GLYCOLIC ACID, (3-INDOLYLCARBONYL)METHYL ESTER, [2-(1H-indol-3-yl)-2-oxoethyl] 2-hydroxyacetate, 2-(1H-Indol-3-yl)-2-oxoethyl hydroxyacetate, 2-(1H-indol-3-yl)-2-oxoethyl 2-hydroxyacetate
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 79.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 38693-04-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C(=O)COC(=O)CO |
| InChIKey | KRKYUCOQXLFDCZ-UHFFFAOYSA-N |
Product Overview
乙醇酸(3-吲哚基羰基)甲酯 (CAS 38693-04-8), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: [2-(1H-indol-3-yl)-2-oxoethyl] 2-hydroxyacetate.
Chemical Property Profile of 乙醇酸(3-吲哚基羰基)甲酯
Property Insights of 乙醇酸(3-吲哚基羰基)甲酯
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙醇酸(3-吲哚基羰基)甲酯. The TPSA of 79.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 乙醇酸(3-吲哚基羰基)甲酯. Following Lipinski's Rule of Five, 乙醇酸(3-吲哚基羰基)甲酯 has 2 hydrogen bond donor(s) and 4 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 乙醇酸(3-吲哚基羰基)甲酯?
The CAS number of 乙醇酸(3-吲哚基羰基)甲酯 is 38693-04-8.
What is the molecular formula of 乙醇酸(3-吲哚基羰基)甲酯?
The molecular formula of 乙醇酸(3-吲哚基羰基)甲酯 is C12H11NO4.
What is the molecular weight of 乙醇酸(3-吲哚基羰基)甲酯?
The molecular weight of 乙醇酸(3-吲哚基羰基)甲酯 is 233.07 g/mol.
Where can I buy 乙醇酸(3-吲哚基羰基)甲酯?
You can request a quote for 乙醇酸(3-吲哚基羰基)甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙醇酸(3-吲哚基羰基)甲酯?
Yes, KEHONG BIO provides custom synthesis services for 乙醇酸(3-吲哚基羰基)甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.