2-庚炔酸
TL;DR: 2-庚炔酸 (CAS 1483-67-6) is a chemical compound with molecular formula C7H10O2 and molecular weight 126.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-庚炔酸
hept-2-ynoic acid
Also Known As: 2-Heptynoic acid, Hept-2-ynoic acid, 2-HEPTYNOICACID, heptynoic acid, 216-048-2
| Molecular Formula | C7H10O2 |
|---|---|
| Molecular Weight | 126.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 126.06808 |
| Heavy Atoms | 9 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 1483-67-6 |
|---|---|
| SMILES | CCCCC#CC(=O)O |
| InChIKey | UEERQXQKEJPYBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-庚炔酸 (CAS 1483-67-6), with molecular formula C7H10O2 and molecular weight 126.07 g/mol. IUPAC: hept-2-ynoic acid.
Chemical Property Profile of 2-庚炔酸
Property Insights of 2-庚炔酸
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-庚炔酸. With a topological polar surface area (TPSA) of 37.3 Ų, 2-庚炔酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-庚炔酸 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 2-庚炔酸?
The CAS number of 2-庚炔酸 is 1483-67-6.
What is the molecular formula of 2-庚炔酸?
The molecular formula of 2-庚炔酸 is C7H10O2.
What is the molecular weight of 2-庚炔酸?
The molecular weight of 2-庚炔酸 is 126.07 g/mol.
Where can I buy 2-庚炔酸?
You can request a quote for 2-庚炔酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-庚炔酸?
Yes, KEHONG BIO provides custom synthesis services for 2-庚炔酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.