异壬酰氯
TL;DR: 异壬酰氯 (CAS 57077-36-8) is a chemical compound with molecular formula C9H17ClO and molecular weight 176.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异壬酰氯
7-methyloctanoyl chloride
Also Known As: Isononanoyl chloride, 7-methyloctanoyl chloride, Isononanoic acid chloride, 7-methyloctanoylchloride, 7-methylcaprylyl chloride
| Molecular Formula | C9H17ClO |
|---|---|
| Molecular Weight | 176.10 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 176.09679 |
| Heavy Atoms | 11 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 57077-36-8 |
|---|---|
| SMILES | CC(C)CCCCCC(=O)Cl |
| InChIKey | GXIQQLXFFZDGHO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异壬酰氯 (CAS 57077-36-8), with molecular formula C9H17ClO and molecular weight 176.10 g/mol. IUPAC: 7-methyloctanoyl chloride.
Chemical Property Profile of 异壬酰氯
Property Insights of 异壬酰氯
The XLogP value of 4.0 indicates that 异壬酰氯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 异壬酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异壬酰氯 has 0 hydrogen bond donor(s) and 1 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 异壬酰氯?
The CAS number of 异壬酰氯 is 57077-36-8.
What is the molecular formula of 异壬酰氯?
The molecular formula of 异壬酰氯 is C9H17ClO.
What is the molecular weight of 异壬酰氯?
The molecular weight of 异壬酰氯 is 176.10 g/mol.
Where can I buy 异壬酰氯?
You can request a quote for 异壬酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异壬酰氯?
Yes, KEHONG BIO provides custom synthesis services for 异壬酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.