Tert-butyl N-butylcarbamate
TL;DR: Tert-butyl N-butylcarbamate (CAS 59255-58-2) is a chemical compound with molecular formula C9H19NO2 and molecular weight 173.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-butylcarbamate
Also Known As: Tert-butyl N-butylcarbamate, tert-butyl butylcarbamate, Carbamic acid, butyl-, 1,1-dimethylethyl ester, Butyl(tert-butoxycarbonyl)amine, N-(n-Butyl)-tert.-butylurethan
| Molecular Formula | C9H19NO2 |
|---|---|
| Molecular Weight | 173.14 g/mol |
| LogP | 2.3112 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 173.14159 |
| Heavy Atoms | 12 |
| Complexity | 137.9542 |
Chemical Identifiers
| CAS Number | 59255-58-2 |
|---|---|
| SMILES | CCCCNC(=O)OC(C)(C)C |
Product Overview
Tert-butyl N-butylcarbamate (CAS 59255-58-2), with molecular formula C9H19NO2 and molecular weight 173.14 g/mol. IUPAC: tert-butyl N-butylcarbamate.
Chemical Property Profile of Tert-butyl N-butylcarbamate
Property Insights of Tert-butyl N-butylcarbamate
The XLogP value of 2.3112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl N-butylcarbamate. With a topological polar surface area (TPSA) of 38.33 Ų, Tert-butyl N-butylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl N-butylcarbamate has 1 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 Tert-butyl N-butylcarbamate?
The CAS number of Tert-butyl N-butylcarbamate is 59255-58-2.
What is the molecular formula of Tert-butyl N-butylcarbamate?
The molecular formula of Tert-butyl N-butylcarbamate is C9H19NO2.
What is the molecular weight of Tert-butyl N-butylcarbamate?
The molecular weight of Tert-butyl N-butylcarbamate is 173.14 g/mol.
Where can I buy Tert-butyl N-butylcarbamate?
You can request a quote for Tert-butyl N-butylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl N-butylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl N-butylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.