tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate
TL;DR: tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate (CAS 168910-03-0) is a chemical compound with molecular formula C9H17NO3 and molecular weight 187.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2-methyloxiran-2-yl)methyl]carbamate
Also Known As: Tert-butyl N-[(2-methyloxiran-2-yl)methyl]carbamate, tert-butyl ((2-methyloxiran-2-yl)methyl)carbamate, Carbamic acid, [(2-methyloxiranyl)methyl]-, 1,1-dimethylethyl ester (9CI), t-Butyl ((2-methyloxiran-2-yl)methyl)carbamate, tert-Butyl N-(2-Methyloxiran-2-yl)methylcarbamate
| Molecular Formula | C9H17NO3 |
|---|---|
| Molecular Weight | 187.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 50.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.12085 |
| Heavy Atoms | 13 |
| Complexity | 203.39558 |
Chemical Identifiers
| CAS Number | 168910-03-0 |
|---|---|
| SMILES | CC1(CO1)CNC(=O)OC(C)(C)C |
Product Overview
tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate (CAS 168910-03-0), with molecular formula C9H17NO3 and molecular weight 187.12 g/mol. IUPAC: tert-butyl N-[(2-methyloxiran-2-yl)methyl]carbamate.
Chemical Property Profile of tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate
Property Insights of tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate. With a topological polar surface area (TPSA) of 50.86 Ų, tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl N-((2-methyloxiran-2-yl)methyl)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 N-((2-methyloxiran-2-yl)methyl)carbamate?
The CAS number of tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate is 168910-03-0.
What is the molecular formula of tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate?
The molecular formula of tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate is C9H17NO3.
What is the molecular weight of tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate?
The molecular weight of tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate is 187.12 g/mol.
Where can I buy tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate?
You can request a quote for tert-butyl N-((2-methyloxiran-2-yl)methyl)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-methyloxiran-2-yl)methyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-((2-methyloxiran-2-yl)methyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.