![2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid structure](/static/products/112/112175-15-2.png)
2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid
TL;DR: 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid (CAS 112175-15-2) is a chemical compound with molecular formula C9H15NO6 and molecular weight 233.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(methoxycarbonyl)amino]-3-methylbutanoic acid
Also Known As: N,N-bis(methoxycarbonyl)valine, L-Valine, N,N-bis(methoxycarbonyl)-, NCI60_006465, 2-[bis(methoxycarbonyl)amino]-3-methylbutanoic acid
| Molecular Formula | C9H15NO6 |
|---|---|
| Molecular Weight | 233.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 233.08994 |
| Heavy Atoms | 16 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 112175-15-2 |
|---|---|
| SMILES | CC(C)C(C(=O)O)N(C(=O)OC)C(=O)OC |
| InChIKey | VVPDGGOGQXQSMA-UHFFFAOYSA-N |
Product Overview
2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid (CAS 112175-15-2), with molecular formula C9H15NO6 and molecular weight 233.09 g/mol. IUPAC: 2-[bis(methoxycarbonyl)amino]-3-methylbutanoic acid.
Chemical Property Profile of 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid
Property Insights of 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid. Following Lipinski's Rule of Five, 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid has 1 hydrogen bond donor(s) and 6 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-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid?
The CAS number of 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid is 112175-15-2.
What is the molecular formula of 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid?
The molecular formula of 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid is C9H15NO6.
What is the molecular weight of 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid?
The molecular weight of 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid is 233.09 g/mol.
Where can I buy 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid?
You can request a quote for 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[Bis(methoxycarbonyl)amino]-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.