2-十八-9-烯酰氧基丙酸
TL;DR: 2-十八-9-烯酰氧基丙酸 (CAS 45290-16-2) is a chemical compound with molecular formula C21H38O4 and molecular weight 354.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-十八-9-烯酰氧基丙酸
2-octadec-9-enoyloxypropanoic acid
Also Known As: 1-Carboxyethyl oleate, 9-Octadecenoic acid(9Z)-, 1-carboxyethyl ester, 9-Octadecenoic acid, 1-carboxyethyl ester, (Z)-
| Molecular Formula | C21H38O4 |
|---|---|
| Molecular Weight | 354.28 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 354.277 |
| Heavy Atoms | 25 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 45290-16-2 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OC(C)C(=O)O |
| InChIKey | QFOLLQAEFFNUKU-UHFFFAOYSA-N |
Product Overview
2-十八-9-烯酰氧基丙酸 (CAS 45290-16-2), with molecular formula C21H38O4 and molecular weight 354.28 g/mol. IUPAC: 2-octadec-9-enoyloxypropanoic acid.
Chemical Property Profile of 2-十八-9-烯酰氧基丙酸
Property Insights of 2-十八-9-烯酰氧基丙酸
The XLogP value of 7.6 indicates that 2-十八-9-烯酰氧基丙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-十八-9-烯酰氧基丙酸. Following Lipinski's Rule of Five, 2-十八-9-烯酰氧基丙酸 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-十八-9-烯酰氧基丙酸?
The CAS number of 2-十八-9-烯酰氧基丙酸 is 45290-16-2.
What is the molecular formula of 2-十八-9-烯酰氧基丙酸?
The molecular formula of 2-十八-9-烯酰氧基丙酸 is C21H38O4.
What is the molecular weight of 2-十八-9-烯酰氧基丙酸?
The molecular weight of 2-十八-9-烯酰氧基丙酸 is 354.28 g/mol.
Where can I buy 2-十八-9-烯酰氧基丙酸?
You can request a quote for 2-十八-9-烯酰氧基丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-十八-9-烯酰氧基丙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-十八-9-烯酰氧基丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.