2-Chloroheptanedioic acid
TL;DR: 2-Chloroheptanedioic acid (CAS 16714-79-7) is a chemical compound with molecular formula C7H11ClO4 and molecular weight 194.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroheptanedioic acid
Also Known As: 2-chloroheptanedioic acid, chloropimelic acid, alpha-Chloro-pimelic acid, RefChem:259512
| Molecular Formula | C7H11ClO4 |
|---|---|
| Molecular Weight | 194.03 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 194.03459 |
| Heavy Atoms | 12 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 16714-79-7 |
|---|---|
| SMILES | C(CCC(=O)O)CC(C(=O)O)Cl |
| InChIKey | YMGDNQLFGMWKNA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloroheptanedioic acid (CAS 16714-79-7), with molecular formula C7H11ClO4 and molecular weight 194.03 g/mol. IUPAC: 2-chloroheptanedioic acid.
Chemical Property Profile of 2-Chloroheptanedioic acid
Property Insights of 2-Chloroheptanedioic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroheptanedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloroheptanedioic acid. Following Lipinski's Rule of Five, 2-Chloroheptanedioic acid has 2 hydrogen bond donor(s) and 4 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 2-Chloroheptanedioic acid?
The CAS number of 2-Chloroheptanedioic acid is 16714-79-7.
What is the molecular formula of 2-Chloroheptanedioic acid?
The molecular formula of 2-Chloroheptanedioic acid is C7H11ClO4.
What is the molecular weight of 2-Chloroheptanedioic acid?
The molecular weight of 2-Chloroheptanedioic acid is 194.03 g/mol.
Where can I buy 2-Chloroheptanedioic acid?
You can request a quote for 2-Chloroheptanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroheptanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroheptanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.