tert-butyl N-(thiophen-3-yl)carbamate
TL;DR: tert-butyl N-(thiophen-3-yl)carbamate (CAS 1932-94-1) is a chemical compound with molecular formula C9H13NO2S and molecular weight 199.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-thiophen-3-ylcarbamate
Also Known As: tert-Butyl thiophen-3-ylcarbamate, N-Boc-3-aminothiophene, tert-Butyl N-(3-thienyl)carbamate, tert-butyl 3-thienylcarbamate, tert-butyl N-(thiophen-3-yl)carbamate
| Molecular Formula | C9H13NO2S |
|---|---|
| Molecular Weight | 199.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.0667 |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 1932-94-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=CSC=C1 |
| InChIKey | PRWYQCYSADTIBZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-butyl N-(thiophen-3-yl)carbamate (CAS 1932-94-1), with molecular formula C9H13NO2S and molecular weight 199.07 g/mol. IUPAC: tert-butyl N-thiophen-3-ylcarbamate.
Chemical Property Profile of tert-butyl N-(thiophen-3-yl)carbamate
Property Insights of tert-butyl N-(thiophen-3-yl)carbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-(thiophen-3-yl)carbamate. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-(thiophen-3-yl)carbamate. Following Lipinski's Rule of Five, tert-butyl N-(thiophen-3-yl)carbamate has 1 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 tert-butyl N-(thiophen-3-yl)carbamate?
The CAS number of tert-butyl N-(thiophen-3-yl)carbamate is 1932-94-1.
What is the molecular formula of tert-butyl N-(thiophen-3-yl)carbamate?
The molecular formula of tert-butyl N-(thiophen-3-yl)carbamate is C9H13NO2S.
What is the molecular weight of tert-butyl N-(thiophen-3-yl)carbamate?
The molecular weight of tert-butyl N-(thiophen-3-yl)carbamate is 199.07 g/mol.
Where can I buy tert-butyl N-(thiophen-3-yl)carbamate?
You can request a quote for tert-butyl N-(thiophen-3-yl)carbamate 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-(thiophen-3-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-(thiophen-3-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.