2,6-Diamino-3-cyclohexene-1-carboxylic acid
TL;DR: 2,6-Diamino-3-cyclohexene-1-carboxylic acid (CAS 1005182-08-0) is a chemical compound with molecular formula C7H12N2O2 and molecular weight 156.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-diaminocyclohex-3-ene-1-carboxylic acid
Also Known As: 2,6-Diamino-4-hexenoic acid, 2,6-diaminocyclohex-3-ene-1-carboxylic acid, 2,6-Diamino-3-cyclohexene-1-carboxylic acid #, 3-Cyclohexene-1-carboxylic acid, 2,6-diamino-
| Molecular Formula | C7H12N2O2 |
|---|---|
| Molecular Weight | 156.09 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 89.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.08987 |
| Heavy Atoms | 11 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 1005182-08-0 |
|---|---|
| SMILES | C1C=CC(C(C1N)C(=O)O)N |
| InChIKey | BJNVMUGXOKRLHE-UHFFFAOYSA-N |
Product Overview
2,6-Diamino-3-cyclohexene-1-carboxylic acid (CAS 1005182-08-0), with molecular formula C7H12N2O2 and molecular weight 156.09 g/mol. IUPAC: 2,6-diaminocyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of 2,6-Diamino-3-cyclohexene-1-carboxylic acid
Property Insights of 2,6-Diamino-3-cyclohexene-1-carboxylic acid
The XLogP value of -2.5 indicates that 2,6-Diamino-3-cyclohexene-1-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Diamino-3-cyclohexene-1-carboxylic acid. Following Lipinski's Rule of Five, 2,6-Diamino-3-cyclohexene-1-carboxylic acid has 3 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 2,6-Diamino-3-cyclohexene-1-carboxylic acid?
The CAS number of 2,6-Diamino-3-cyclohexene-1-carboxylic acid is 1005182-08-0.
What is the molecular formula of 2,6-Diamino-3-cyclohexene-1-carboxylic acid?
The molecular formula of 2,6-Diamino-3-cyclohexene-1-carboxylic acid is C7H12N2O2.
What is the molecular weight of 2,6-Diamino-3-cyclohexene-1-carboxylic acid?
The molecular weight of 2,6-Diamino-3-cyclohexene-1-carboxylic acid is 156.09 g/mol.
Where can I buy 2,6-Diamino-3-cyclohexene-1-carboxylic acid?
You can request a quote for 2,6-Diamino-3-cyclohexene-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Diamino-3-cyclohexene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Diamino-3-cyclohexene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.