山梨酸
TL;DR: 山梨酸 (CAS 110-44-1) is a chemical compound with molecular formula C6H8O2 and molecular weight 112.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
山梨酸
hexa-2,4-dienoic acid
Also Known As: sorbic acid, Hexa-2,4-dienoic acid, 2,4-Hexadienoic acid, Hexadienoic acid, Sorbicacid
| Molecular Formula | C6H8O2 |
|---|---|
| Molecular Weight | 112.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 112.05243 |
| Heavy Atoms | 8 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 110-44-1 |
|---|---|
| SMILES | CC=CC=CC(=O)O |
| InChIKey | WSWCOQWTEOXDQX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
山梨酸 (CAS 110-44-1), with molecular formula C6H8O2 and molecular weight 112.05 g/mol. IUPAC: hexa-2,4-dienoic acid.
Chemical Property Profile of 山梨酸
Property Insights of 山梨酸
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 山梨酸. With a topological polar surface area (TPSA) of 37.3 Ų, 山梨酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 山梨酸 has 1 hydrogen bond donor(s) and 2 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 山梨酸?
The CAS number of 山梨酸 is 110-44-1.
What is the molecular formula of 山梨酸?
The molecular formula of 山梨酸 is C6H8O2.
What is the molecular weight of 山梨酸?
The molecular weight of 山梨酸 is 112.05 g/mol.
Where can I buy 山梨酸?
You can request a quote for 山梨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 山梨酸?
Yes, KEHONG BIO provides custom synthesis services for 山梨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.