tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate
TL;DR: tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate (CAS 220871-52-3) is a chemical compound with molecular formula C15H21NO3 and molecular weight 263.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(1S)-1-(oxiran-2-yl)-2-phenylethyl]carbamate
Also Known As: tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate, (2R,3S)-3-(BOC-)AMINO-1,2-EPOXY-4-PHENYLBUTANE, (S)-(1-oxiranyl-2-phenylethyl)-carbamic acid tert-butyl ester, (2R,3S)-3-(tert-Butoxycarbonyl)amino-1,2-epoxy-4-phenylbutane, Tert-butyl N-[(1S)-1-[(2S)-oxiran-2-yl]-2-phenyl-ethyl]carbamate
| Molecular Formula | C15H21NO3 |
|---|---|
| Molecular Weight | 263.15 g/mol |
| LogP | 2.5212 |
| Topological Polar Surface Area | 50.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.15213 |
| Heavy Atoms | 19 |
| Complexity | 420.76688 |
Chemical Identifiers
| CAS Number | 220871-52-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C2CO2 |
Product Overview
tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate (CAS 220871-52-3), with molecular formula C15H21NO3 and molecular weight 263.15 g/mol. IUPAC: tert-butyl N-[(1S)-1-(oxiran-2-yl)-2-phenylethyl]carbamate.
Chemical Property Profile of tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate
Property Insights of tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate
The XLogP value of 2.5212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate. With a topological polar surface area (TPSA) of 50.86 Ų, tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)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 ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate?
The CAS number of tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate is 220871-52-3.
What is the molecular formula of tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate?
The molecular formula of tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate is C15H21NO3.
What is the molecular weight of tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate?
The molecular weight of tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate is 263.15 g/mol.
Where can I buy tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate?
You can request a quote for tert-butyl ((1S)-1-(oxiran-2-yl)-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 ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl ((1S)-1-(oxiran-2-yl)-2-phenylethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.