![2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid structure](/static/products/1217/1217643-80-5.webp)
2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid
TL;DR: 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid (CAS 1217643-80-5) is a chemical compound with molecular formula C13H16ClNO4 and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
Also Known As: N-Boc-(3'-chlorophenyl)glycine, 2-((tert-Butoxycarbonyl)amino)-2-(3-chlorophenyl)acetic acid, [(tert-butoxycarbonyl)amino](3-chlorophenyl)acetic acid, n-boc-2-(3'-chlorophenyl)-dl-glycine, n-boc-(3-chlorophenyl)glycine
| Molecular Formula | C13H16ClNO4 |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | 2.9904 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.07678 |
| Heavy Atoms | 19 |
| Complexity | 481.7767 |
Chemical Identifiers
| CAS Number | 1217643-80-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(C1=CC(=CC=C1)Cl)C(=O)O |
Product Overview
2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid (CAS 1217643-80-5), with molecular formula C13H16ClNO4 and molecular weight 285.08 g/mol. IUPAC: 2-(3-chlorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid.
Chemical Property Profile of 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid
Property Insights of 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid
The XLogP value of 2.9904 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid. Following Lipinski's Rule of Five, 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic 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}-2-(3-chlorophenyl)acetic acid?
The CAS number of 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid is 1217643-80-5.
What is the molecular formula of 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid?
The molecular formula of 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid is C13H16ClNO4.
What is the molecular weight of 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid?
The molecular weight of 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid is 285.08 g/mol.
Where can I buy 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid?
You can request a quote for 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic 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}-2-(3-chlorophenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(Tert-butoxy)carbonyl]amino}-2-(3-chlorophenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.