Dimethyl 2-(tert-butoxycarbonylamino)butanedioate
TL;DR: Dimethyl 2-(tert-butoxycarbonylamino)butanedioate (CAS 130622-08-1) is a chemical compound with molecular formula C11H19NO6 and molecular weight 261.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate
Also Known As: Boc-Asp(Ome)-Ome, dimethyl N-tert-butoxycarbonyl-L-aspartate, dimethyl 2-(tert-butoxycarbonylamino)butanedioate, (R)-Dimethyl 2-((tert-butoxycarbonyl)amino)succinate, Dimethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate
| Molecular Formula | C11H19NO6 |
|---|---|
| Molecular Weight | 261.12 g/mol |
| LogP | 0.6158 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.12125 |
| Heavy Atoms | 18 |
| Complexity | 319.98535 |
Chemical Identifiers
| CAS Number | 130622-08-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(CC(=O)OC)C(=O)OC |
Product Overview
Dimethyl 2-(tert-butoxycarbonylamino)butanedioate (CAS 130622-08-1), with molecular formula C11H19NO6 and molecular weight 261.12 g/mol. IUPAC: dimethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate.
Chemical Property Profile of Dimethyl 2-(tert-butoxycarbonylamino)butanedioate
Property Insights of Dimethyl 2-(tert-butoxycarbonylamino)butanedioate
The XLogP value of 0.6158 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2-(tert-butoxycarbonylamino)butanedioate. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-(tert-butoxycarbonylamino)butanedioate. Following Lipinski's Rule of Five, Dimethyl 2-(tert-butoxycarbonylamino)butanedioate 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 Dimethyl 2-(tert-butoxycarbonylamino)butanedioate?
The CAS number of Dimethyl 2-(tert-butoxycarbonylamino)butanedioate is 130622-08-1.
What is the molecular formula of Dimethyl 2-(tert-butoxycarbonylamino)butanedioate?
The molecular formula of Dimethyl 2-(tert-butoxycarbonylamino)butanedioate is C11H19NO6.
What is the molecular weight of Dimethyl 2-(tert-butoxycarbonylamino)butanedioate?
The molecular weight of Dimethyl 2-(tert-butoxycarbonylamino)butanedioate is 261.12 g/mol.
Where can I buy Dimethyl 2-(tert-butoxycarbonylamino)butanedioate?
You can request a quote for Dimethyl 2-(tert-butoxycarbonylamino)butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-(tert-butoxycarbonylamino)butanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-(tert-butoxycarbonylamino)butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.