tert-butyl N-(2-amino-2-phenylethyl)carbamate
TL;DR: tert-butyl N-(2-amino-2-phenylethyl)carbamate (CAS 400652-57-5) is a chemical compound with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(2-amino-2-phenylethyl)carbamate
Also Known As: (2-Amino-2-phenyl-ethyl)-carbamic acid tert-butyl ester, tert-butyl N-(2-amino-2-phenylethyl)carbamate, TERT-BUTYL (2-AMINO-2-PHENYLETHYL)CARBAMATE, N-Boc-2-amino-2-phenylethylamine, (R)-N2-Boc-1-phenylethylenediamine
| Molecular Formula | C13H20N2O2 |
|---|---|
| Molecular Weight | 236.15 g/mol |
| LogP | 2.2111 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.15248 |
| Heavy Atoms | 17 |
| Complexity | 357.43225 |
Chemical Identifiers
| CAS Number | 400652-57-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCC(C1=CC=CC=C1)N |
Product Overview
tert-butyl N-(2-amino-2-phenylethyl)carbamate (CAS 400652-57-5), with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol. IUPAC: tert-butyl N-(2-amino-2-phenylethyl)carbamate.
Chemical Property Profile of tert-butyl N-(2-amino-2-phenylethyl)carbamate
Property Insights of tert-butyl N-(2-amino-2-phenylethyl)carbamate
The XLogP value of 2.2111 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-(2-amino-2-phenylethyl)carbamate. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-(2-amino-2-phenylethyl)carbamate. Following Lipinski's Rule of Five, tert-butyl N-(2-amino-2-phenylethyl)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 N-(2-amino-2-phenylethyl)carbamate?
The CAS number of tert-butyl N-(2-amino-2-phenylethyl)carbamate is 400652-57-5.
What is the molecular formula of tert-butyl N-(2-amino-2-phenylethyl)carbamate?
The molecular formula of tert-butyl N-(2-amino-2-phenylethyl)carbamate is C13H20N2O2.
What is the molecular weight of tert-butyl N-(2-amino-2-phenylethyl)carbamate?
The molecular weight of tert-butyl N-(2-amino-2-phenylethyl)carbamate is 236.15 g/mol.
Where can I buy tert-butyl N-(2-amino-2-phenylethyl)carbamate?
You can request a quote for tert-butyl N-(2-amino-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-amino-2-phenylethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-(2-amino-2-phenylethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.