ethyl N-tert-butyliminocarbamate
TL;DR: ethyl N-tert-butyliminocarbamate (CAS 90270-99-8) is a chemical compound with molecular formula C7H14N2O2 and molecular weight 158.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-tert-butyliminocarbamate
Also Known As: ethyl N-tert-butyliminocarbamate, N(1)-p-Tolyl-N(5)-n-octylbiguanid, N(1)-tert.-Butyl-azo-carbonsaeure-ethylester
| Molecular Formula | C7H14N2O2 |
|---|---|
| Molecular Weight | 158.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 158.10553 |
| Heavy Atoms | 11 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 90270-99-8 |
|---|---|
| SMILES | CCOC(=O)N=NC(C)(C)C |
| InChIKey | AOIWWESGWZVJHS-UHFFFAOYSA-N |
Product Overview
ethyl N-tert-butyliminocarbamate (CAS 90270-99-8), with molecular formula C7H14N2O2 and molecular weight 158.11 g/mol. IUPAC: ethyl N-tert-butyliminocarbamate.
Chemical Property Profile of ethyl N-tert-butyliminocarbamate
Property Insights of ethyl N-tert-butyliminocarbamate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-tert-butyliminocarbamate. With a topological polar surface area (TPSA) of 51.0 Ų, ethyl N-tert-butyliminocarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-tert-butyliminocarbamate has 0 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 ethyl N-tert-butyliminocarbamate?
The CAS number of ethyl N-tert-butyliminocarbamate is 90270-99-8.
What is the molecular formula of ethyl N-tert-butyliminocarbamate?
The molecular formula of ethyl N-tert-butyliminocarbamate is C7H14N2O2.
What is the molecular weight of ethyl N-tert-butyliminocarbamate?
The molecular weight of ethyl N-tert-butyliminocarbamate is 158.11 g/mol.
Where can I buy ethyl N-tert-butyliminocarbamate?
You can request a quote for ethyl N-tert-butyliminocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-tert-butyliminocarbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-tert-butyliminocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.