Methyl 2-bromooctadecanoate
TL;DR: Methyl 2-bromooctadecanoate (CAS 3196-18-7) is a chemical compound with molecular formula C19H37BrO2 and molecular weight 376.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-bromooctadecanoate
Also Known As: methyl bromostearate, Methyl 2-bromooctadecanoate, Methyl alpha-bromostearate, Methyl .alpha.-bromostearate, Methyl 2-bromooctadecanoate #
| Molecular Formula | C19H37BrO2 |
|---|---|
| Molecular Weight | 376.20 g/mol |
| LogP | 9.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 376.1977 |
| Heavy Atoms | 22 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 3196-18-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCC(C(=O)OC)Br |
| InChIKey | ZPTFWUBUFNGZPL-UHFFFAOYSA-N |
Product Overview
Methyl 2-bromooctadecanoate (CAS 3196-18-7), with molecular formula C19H37BrO2 and molecular weight 376.20 g/mol. IUPAC: methyl 2-bromooctadecanoate.
Chemical Property Profile of Methyl 2-bromooctadecanoate
Property Insights of Methyl 2-bromooctadecanoate
The XLogP value of 9.2 indicates that Methyl 2-bromooctadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 2-bromooctadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-bromooctadecanoate 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 Methyl 2-bromooctadecanoate?
The CAS number of Methyl 2-bromooctadecanoate is 3196-18-7.
What is the molecular formula of Methyl 2-bromooctadecanoate?
The molecular formula of Methyl 2-bromooctadecanoate is C19H37BrO2.
What is the molecular weight of Methyl 2-bromooctadecanoate?
The molecular weight of Methyl 2-bromooctadecanoate is 376.20 g/mol.
Where can I buy Methyl 2-bromooctadecanoate?
You can request a quote for Methyl 2-bromooctadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-bromooctadecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-bromooctadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.