Einecs 258-021-8
TL;DR: Einecs 258-021-8 (CAS 52584-01-7) is a chemical compound with molecular formula C40H76N2O3 and molecular weight 632.59 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(Z)-heptadec-8-enyl]-4,5-dihydroimidazol-1-yl]ethanol;(Z)-octadec-9-enoic acid
Also Known As: EINECS 258-021-8, Oleic acid, compound with (Z)-2-(heptadec-8-enyl)-4,5-dihydro-1H-imidazole-1-ethanol (1:1), 9-Octadecenoic acid (Z)-, compd. with (Z)-2-(8-heptadecenyl)-4,5-dihydro-1H-imidazole-1-ethanol (1:1), 2-[2-[(Z)-heptadec-8-enyl]-4,5-dihydroimidazol-1-yl]ethanol; (Z)-octadec-9-enoic acid, 9-Octadecenoic acid (9Z)-, compd. with 2-(8-heptadecenyl)-4,5-dihydro-1H-imidazole-1-ethanol (1:1)
| Molecular Formula | C40H76N2O3 |
|---|---|
| Molecular Weight | 632.59 g/mol |
| LogP | 11.8388 |
| Topological Polar Surface Area | 73.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 32 |
| Exact Mass | 632.5856 |
| Heavy Atoms | 45 |
| Complexity | 703.65326 |
Chemical Identifiers
| CAS Number | 52584-01-7 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC1=NCCN1CCO.CCCCCCCC/C=C\CCCCCCCC(=O)O |
Product Overview
Einecs 258-021-8 (CAS 52584-01-7), with molecular formula C40H76N2O3 and molecular weight 632.59 g/mol. IUPAC: 2-[2-[(Z)-heptadec-8-enyl]-4,5-dihydroimidazol-1-yl]ethanol;(Z)-octadec-9-enoic acid.
Chemical Property Profile of Einecs 258-021-8
Property Insights of Einecs 258-021-8
The XLogP value of 11.8388 indicates that Einecs 258-021-8 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 258-021-8. Following Lipinski's Rule of Five, Einecs 258-021-8 has 2 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 Einecs 258-021-8?
The CAS number of Einecs 258-021-8 is 52584-01-7.
What is the molecular formula of Einecs 258-021-8?
The molecular formula of Einecs 258-021-8 is C40H76N2O3.
What is the molecular weight of Einecs 258-021-8?
The molecular weight of Einecs 258-021-8 is 632.59 g/mol.
Where can I buy Einecs 258-021-8?
You can request a quote for Einecs 258-021-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 258-021-8?
Yes, KEHONG BIO provides custom synthesis services for Einecs 258-021-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.