硬脂酸甲酯
TL;DR: 硬脂酸甲酯 (CAS 112-61-8) is a chemical compound with molecular formula C19H38O2 and molecular weight 298.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硬脂酸甲酯
methyl octadecanoate
Also Known As: METHYL STEARATE, Methyl octadecanoate, Kemester 9718, Stearic acid methyl ester, Metholene 2218
| Molecular Formula | C19H38O2 |
|---|---|
| Molecular Weight | 298.29 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 298.28717 |
| Heavy Atoms | 21 |
| Complexity | 214.0 |
| Melting Point | 37.8 °C |
| Boiling Point | 828 to 442.8 °C at 747 mmHg |
| Density | 0.8498 at 40.0 °C - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| Flash Point | 152.8 °C |
| Vapor Pressure | 0.0000136 [mmHg] |
| Refractive Index | 1.4367 @ 40 °C |
Chemical Identifiers
| CAS Number | 112-61-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OC |
| InChIKey | HPEUJPJOZXNMSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硬脂酸甲酯 (CAS 112-61-8), with molecular formula C19H38O2 and molecular weight 298.29 g/mol. IUPAC: methyl octadecanoate.
Chemical Property Profile of 硬脂酸甲酯
Property Insights of 硬脂酸甲酯
The XLogP value of 9.0 indicates that 硬脂酸甲酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 硬脂酸甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 硬脂酸甲酯 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硬脂酸甲酯?
The CAS number of 硬脂酸甲酯 is 112-61-8.
What is the molecular formula of 硬脂酸甲酯?
The molecular formula of 硬脂酸甲酯 is C19H38O2.
What is the molecular weight of 硬脂酸甲酯?
The molecular weight of 硬脂酸甲酯 is 298.29 g/mol.
Where can I buy 硬脂酸甲酯?
You can request a quote for 硬脂酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硬脂酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for 硬脂酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.