tert-Butyl (4-aminophenyl)carbamate
TL;DR: tert-Butyl (4-aminophenyl)carbamate (CAS 71491-96-8) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(4-aminophenyl)carbamate
Also Known As: tert-Butyl (4-aminophenyl)carbamate, N-Boc-p-phenylenediamine, 4-(tert-Butoxycarbonylamino)aniline, tert-butyl 4-aminophenylcarbamate, N-Boc-1,4-phenylenediamine
| Molecular Formula | C11H16N2O2 |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.12119 |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 71491-96-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=CC=C(C=C1)N |
| InChIKey | WIVYTYZCVWHWSH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-Butyl (4-aminophenyl)carbamate (CAS 71491-96-8), with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol. IUPAC: tert-butyl N-(4-aminophenyl)carbamate.
Chemical Property Profile of tert-Butyl (4-aminophenyl)carbamate
Property Insights of tert-Butyl (4-aminophenyl)carbamate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl (4-aminophenyl)carbamate. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-Butyl (4-aminophenyl)carbamate. Following Lipinski's Rule of Five, tert-Butyl (4-aminophenyl)carbamate 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 tert-Butyl (4-aminophenyl)carbamate?
The CAS number of tert-Butyl (4-aminophenyl)carbamate is 71491-96-8.
What is the molecular formula of tert-Butyl (4-aminophenyl)carbamate?
The molecular formula of tert-Butyl (4-aminophenyl)carbamate is C11H16N2O2.
What is the molecular weight of tert-Butyl (4-aminophenyl)carbamate?
The molecular weight of tert-Butyl (4-aminophenyl)carbamate is 208.12 g/mol.
Where can I buy tert-Butyl (4-aminophenyl)carbamate?
You can request a quote for tert-Butyl (4-aminophenyl)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 (4-aminophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl (4-aminophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.