1,4,5,6-四氢-2-吡啶甲酸
TL;DR: 1,4,5,6-四氢-2-吡啶甲酸 (CAS 6635-04-7) is a chemical compound with molecular formula C1CC=C(NC1)C(=O)O and molecular weight 127.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5,6-四氢-2-吡啶甲酸
1,2,3,4-tetrahydropyridine-6-carboxylic acid
Also Known As: 1,4,5,6-tetrahydropyridine-2-carboxylic acid, delta(2)-Piperidine-2-carboxylic acid, delta(2)-Piperideine-2-carboxylate, 1,2,3,4-tetrahydropyridine-6-carboxylic acid, 1,4,5,6-tetrahydropyridine-2-carboxylicacid
| Molecular Formula | C1CC=C(NC1)C(=O)O |
|---|---|
| Molecular Weight | 127.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 127.06333 |
| Heavy Atoms | 9 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 6635-04-7 |
|---|---|
| SMILES | C1CC=C(NC1)C(=O)O |
| InChIKey | SYHALQNMKJVYAZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,5,6-四氢-2-吡啶甲酸 (CAS 6635-04-7), with molecular formula C1CC=C(NC1)C(=O)O and molecular weight 127.06 g/mol. IUPAC: 1,2,3,4-tetrahydropyridine-6-carboxylic acid.
Chemical Property Profile of 1,4,5,6-四氢-2-吡啶甲酸
Property Insights of 1,4,5,6-四氢-2-吡啶甲酸
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,5,6-四氢-2-吡啶甲酸. With a topological polar surface area (TPSA) of 49.3 Ų, 1,4,5,6-四氢-2-吡啶甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,5,6-四氢-2-吡啶甲酸 has 2 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 1,4,5,6-四氢-2-吡啶甲酸?
The CAS number of 1,4,5,6-四氢-2-吡啶甲酸 is 6635-04-7.
What is the molecular formula of 1,4,5,6-四氢-2-吡啶甲酸?
The molecular formula of 1,4,5,6-四氢-2-吡啶甲酸 is C1CC=C(NC1)C(=O)O.
What is the molecular weight of 1,4,5,6-四氢-2-吡啶甲酸?
The molecular weight of 1,4,5,6-四氢-2-吡啶甲酸 is 127.06 g/mol.
Where can I buy 1,4,5,6-四氢-2-吡啶甲酸?
You can request a quote for 1,4,5,6-四氢-2-吡啶甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,5,6-四氢-2-吡啶甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1,4,5,6-四氢-2-吡啶甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.