Tert-butyl N-(4-(aminomethyl)phenyl)carbamate
TL;DR: Tert-butyl N-(4-(aminomethyl)phenyl)carbamate (CAS 108468-00-4) is a chemical compound with molecular formula C12H18N2O2 and molecular weight 222.13683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[4-(aminomethyl)phenyl]carbamate
Also Known As: Tert-butyl N-[4-(aminomethyl)phenyl]carbamate, 4-(BOC-AMINO)BENZYLAMINE, 4-(Aminomethyl)-1-N-Boc-aniline, tert-Butyl (4-(aminomethyl)phenyl)carbamate, 4-BOC-aminobenzylamine
Technical Specifications
| Molecular Formula | C12H18N2O2 |
| Molecular Weight | 222.13683 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.13683 Da |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
| SMILES | CC(C)(C)OC(=O)NC1=CC=C(C=C1)CN |
| InChIKey | URXUHALBOWYXJZ-UHFFFAOYSA-N |
Chemical Property Profile of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate
Property Insights of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl N-(4-(aminomethyl)phenyl)carbamate. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl N-(4-(aminomethyl)phenyl)carbamate. Following Lipinski's Rule of Five, Tert-butyl N-(4-(aminomethyl)phenyl)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
What is the CAS number of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate?
The CAS number of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate is 108468-00-4.
What is the molecular formula of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate?
The molecular formula of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate is C12H18N2O2.
What is the molecular weight of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate?
The molecular weight of Tert-butyl N-(4-(aminomethyl)phenyl)carbamate is 222.13683 g/mol.
Where can I buy Tert-butyl N-(4-(aminomethyl)phenyl)carbamate?
You can request a quote for Tert-butyl N-(4-(aminomethyl)phenyl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tert-butyl N-(4-(aminomethyl)phenyl)carbamate?
Yes, CoreyChem provides custom synthesis services for Tert-butyl N-(4-(aminomethyl)phenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.