6-氰基己酸
TL;DR: 6-氰基己酸 (CAS 5602-19-7) is a chemical compound with molecular formula C7H11NO2 and molecular weight 141.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-氰基己酸
6-cyanohexanoic acid
Also Known As: 6-Cyanohexanoic acid, 6-Cyanocaproic acid, 6-Cyanohexanoicacid, Hexanoic acid, 6-cyano-, epsilon-Cyanocaproic acid
| Molecular Formula | C7H11NO2 |
|---|---|
| Molecular Weight | 141.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 61.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 141.07898 |
| Heavy Atoms | 10 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 5602-19-7 |
|---|---|
| SMILES | C(CCC#N)CCC(=O)O |
| InChIKey | INHNHRQXVDVIDZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-氰基己酸 (CAS 5602-19-7), with molecular formula C7H11NO2 and molecular weight 141.08 g/mol. IUPAC: 6-cyanohexanoic acid.
Chemical Property Profile of 6-氰基己酸
Property Insights of 6-氰基己酸
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-氰基己酸. The TPSA of 61.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-氰基己酸. Following Lipinski's Rule of Five, 6-氰基己酸 has 1 hydrogen bond donor(s) and 3 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 6-氰基己酸?
The CAS number of 6-氰基己酸 is 5602-19-7.
What is the molecular formula of 6-氰基己酸?
The molecular formula of 6-氰基己酸 is C7H11NO2.
What is the molecular weight of 6-氰基己酸?
The molecular weight of 6-氰基己酸 is 141.08 g/mol.
Where can I buy 6-氰基己酸?
You can request a quote for 6-氰基己酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-氰基己酸?
Yes, KEHONG BIO provides custom synthesis services for 6-氰基己酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.