1-Chloro-6-heptadecyne
TL;DR: 1-Chloro-6-heptadecyne (CAS 56599-59-8) is a chemical compound with molecular formula C17H31Cl and molecular weight 270.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloroheptadec-6-yne
Also Known As: 1-Chloro-6-heptadecyne, 1-chloroheptadec-6-yne, 6-Heptadecyne, 1-chloro-, 1-chloro-heptadec-6-yne, 1-Chloro-6-heptadecyne #
| Molecular Formula | C17H31Cl |
|---|---|
| Molecular Weight | 270.21 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 12 |
| Exact Mass | 270.21143 |
| Heavy Atoms | 18 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 56599-59-8 |
|---|---|
| SMILES | CCCCCCCCCCC#CCCCCCCl |
| InChIKey | YUBSSAFQFZDRNW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-6-heptadecyne (CAS 56599-59-8), with molecular formula C17H31Cl and molecular weight 270.21 g/mol. IUPAC: 1-chloroheptadec-6-yne.
Chemical Property Profile of 1-Chloro-6-heptadecyne
Property Insights of 1-Chloro-6-heptadecyne
The XLogP value of 7.9 indicates that 1-Chloro-6-heptadecyne is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chloro-6-heptadecyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-6-heptadecyne has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Chloro-6-heptadecyne?
The CAS number of 1-Chloro-6-heptadecyne is 56599-59-8.
What is the molecular formula of 1-Chloro-6-heptadecyne?
The molecular formula of 1-Chloro-6-heptadecyne is C17H31Cl.
What is the molecular weight of 1-Chloro-6-heptadecyne?
The molecular weight of 1-Chloro-6-heptadecyne is 270.21 g/mol.
Where can I buy 1-Chloro-6-heptadecyne?
You can request a quote for 1-Chloro-6-heptadecyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-6-heptadecyne?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-6-heptadecyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.