4-(Octan-2-ylamino)-4-oxobutanoic acid
TL;DR: 4-(Octan-2-ylamino)-4-oxobutanoic acid (CAS 732256-16-5) is a chemical compound with molecular formula C12H23NO3 and molecular weight 229.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(octan-2-ylamino)-4-oxobutanoic acid
Also Known As: 4-(octan-2-ylamino)-4-oxobutanoic acid, 3-(octan-2-ylcarbamoyl)propanoic Acid, 3-[(OCTAN-2-YL)CARBAMOYL]PROPANOIC ACID, 4-(1-methylheptylamino)-4-oxo-butanoic acid
| Molecular Formula | C12H23NO3 |
|---|---|
| Molecular Weight | 229.17 g/mol |
| LogP | 2.3263 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 229.1678 |
| Heavy Atoms | 16 |
| Complexity | 216.30942 |
Chemical Identifiers
| CAS Number | 732256-16-5 |
|---|---|
| SMILES | CCCCCCC(C)NC(=O)CCC(=O)O |
Product Overview
4-(Octan-2-ylamino)-4-oxobutanoic acid (CAS 732256-16-5), with molecular formula C12H23NO3 and molecular weight 229.17 g/mol. IUPAC: 4-(octan-2-ylamino)-4-oxobutanoic acid.
Chemical Property Profile of 4-(Octan-2-ylamino)-4-oxobutanoic acid
Property Insights of 4-(Octan-2-ylamino)-4-oxobutanoic acid
The XLogP value of 2.3263 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Octan-2-ylamino)-4-oxobutanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Octan-2-ylamino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-(Octan-2-ylamino)-4-oxobutanoic acid has 2 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 4-(Octan-2-ylamino)-4-oxobutanoic acid?
The CAS number of 4-(Octan-2-ylamino)-4-oxobutanoic acid is 732256-16-5.
What is the molecular formula of 4-(Octan-2-ylamino)-4-oxobutanoic acid?
The molecular formula of 4-(Octan-2-ylamino)-4-oxobutanoic acid is C12H23NO3.
What is the molecular weight of 4-(Octan-2-ylamino)-4-oxobutanoic acid?
The molecular weight of 4-(Octan-2-ylamino)-4-oxobutanoic acid is 229.17 g/mol.
Where can I buy 4-(Octan-2-ylamino)-4-oxobutanoic acid?
You can request a quote for 4-(Octan-2-ylamino)-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Octan-2-ylamino)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Octan-2-ylamino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.