tert-butyl N-(2-phenylethyl)carbamate
TL;DR: tert-butyl N-(2-phenylethyl)carbamate (CAS 81616-14-0) is a chemical compound with molecular formula C13H19NO2 and molecular weight 221.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(2-phenylethyl)carbamate
Also Known As: tert-Butyl N-(2-phenylethyl)carbamate, n-boc-phenethylamine, tert-butyl N-phenethylcarbamate, N-Boc-Benzeneethanamine, tert-Butyl phenethylcarbamate
| Molecular Formula | C13H19NO2 |
|---|---|
| Molecular Weight | 221.14 g/mol |
| LogP | 2.7538 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.14159 |
| Heavy Atoms | 16 |
| Complexity | 327.53586 |
Chemical Identifiers
| CAS Number | 81616-14-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCC1=CC=CC=C1 |
Product Overview
tert-butyl N-(2-phenylethyl)carbamate (CAS 81616-14-0), with molecular formula C13H19NO2 and molecular weight 221.14 g/mol. IUPAC: tert-butyl N-(2-phenylethyl)carbamate.
Chemical Property Profile of tert-butyl N-(2-phenylethyl)carbamate
Property Insights of tert-butyl N-(2-phenylethyl)carbamate
The XLogP value of 2.7538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-(2-phenylethyl)carbamate. With a topological polar surface area (TPSA) of 38.33 Ų, tert-butyl N-(2-phenylethyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl N-(2-phenylethyl)carbamate 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-(2-phenylethyl)carbamate?
The CAS number of tert-butyl N-(2-phenylethyl)carbamate is 81616-14-0.
What is the molecular formula of tert-butyl N-(2-phenylethyl)carbamate?
The molecular formula of tert-butyl N-(2-phenylethyl)carbamate is C13H19NO2.
What is the molecular weight of tert-butyl N-(2-phenylethyl)carbamate?
The molecular weight of tert-butyl N-(2-phenylethyl)carbamate is 221.14 g/mol.
Where can I buy tert-butyl N-(2-phenylethyl)carbamate?
You can request a quote for tert-butyl N-(2-phenylethyl)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-(2-phenylethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-(2-phenylethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.