吲哚-3-乙酸阴离子
TL;DR: 吲哚-3-乙酸阴离子 (CAS 93672-51-6) is a chemical compound with molecular formula C10H8NO2- and molecular weight 174.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吲哚-3-乙酸阴离子
2-(1H-indol-3-yl)acetate
Also Known As: indole-3-acetate, auxin, 3-indoleacetate, indoleacetate, 1H-indol-3-ylacetate
| Molecular Formula | C10H8NO2- |
|---|---|
| Molecular Weight | 174.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.0555 |
| Heavy Atoms | 13 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 93672-51-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC(=O)[O-] |
| InChIKey | SEOVTRFCIGRIMH-UHFFFAOYSA-M |
Product Overview
吲哚-3-乙酸阴离子 (CAS 93672-51-6), with molecular formula C10H8NO2- and molecular weight 174.06 g/mol. IUPAC: 2-(1H-indol-3-yl)acetate.
Chemical Property Profile of 吲哚-3-乙酸阴离子
Property Insights of 吲哚-3-乙酸阴离子
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 吲哚-3-乙酸阴离子. With a topological polar surface area (TPSA) of 55.9 Ų, 吲哚-3-乙酸阴离子 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 吲哚-3-乙酸阴离子 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 吲哚-3-乙酸阴离子?
The CAS number of 吲哚-3-乙酸阴离子 is 93672-51-6.
What is the molecular formula of 吲哚-3-乙酸阴离子?
The molecular formula of 吲哚-3-乙酸阴离子 is C10H8NO2-.
What is the molecular weight of 吲哚-3-乙酸阴离子?
The molecular weight of 吲哚-3-乙酸阴离子 is 174.06 g/mol.
Where can I buy 吲哚-3-乙酸阴离子?
You can request a quote for 吲哚-3-乙酸阴离子 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吲哚-3-乙酸阴离子?
Yes, KEHONG BIO provides custom synthesis services for 吲哚-3-乙酸阴离子 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.