![2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid structure](/static/products/6697/669713-57-9.webp)
2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid
TL;DR: 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid (CAS 669713-57-9) is a chemical compound with molecular formula C14H19NO4 and molecular weight 265.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid
Also Known As: D-CAMPHOLICACID, boc-2-amino-3,5-dimethylbenzoic acid, 2-((tert-Butoxycarbonyl)amino)-3,5-dimethylbenzoic acid, n-boc-3,5-dimethylanthranilic acid, 2-tert-Butoxycarbonylamino-3,5-dimethylbenzoic acid
| Molecular Formula | C14H19NO4 |
|---|---|
| Molecular Weight | 265.13 g/mol |
| LogP | 3.34864 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.1314 |
| Heavy Atoms | 19 |
| Complexity | 514.91266 |
Chemical Identifiers
| CAS Number | 669713-57-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C(=O)O)NC(=O)OC(C)(C)C)C |
Product Overview
2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid (CAS 669713-57-9), with molecular formula C14H19NO4 and molecular weight 265.13 g/mol. IUPAC: 3,5-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid.
Chemical Property Profile of 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid
Property Insights of 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid
The XLogP value of 3.34864 indicates that 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid. Following Lipinski's Rule of Five, 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid 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 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid?
The CAS number of 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid is 669713-57-9.
What is the molecular formula of 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid?
The molecular formula of 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid is C14H19NO4.
What is the molecular weight of 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid?
The molecular weight of 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid is 265.13 g/mol.
Where can I buy 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid?
You can request a quote for 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(Tert-butoxy)carbonyl]amino}-3,5-dimethylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.