Ethyl bromoacetimidate
TL;DR: Ethyl bromoacetimidate (CAS 930-70-1) is a chemical compound with molecular formula C4H8BrNO and molecular weight 164.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-bromoethanimidate
Also Known As: Ethyl bromoacetimidate, ethyl 2-bromoethanimidate, ethyl(1e)-2-bromoethanimidoate, ethyl 2-bromoethanecarboximidate, Ethanimidic acid, 2-bromo-, ethyl ester
| Molecular Formula | C4H8BrNO |
|---|---|
| Molecular Weight | 164.98 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.97893 |
| Heavy Atoms | 7 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 930-70-1 |
|---|---|
| SMILES | CCOC(=N)CBr |
| InChIKey | UHRNNTJUJLITEJ-UHFFFAOYSA-N |
Product Overview
Ethyl bromoacetimidate (CAS 930-70-1), with molecular formula C4H8BrNO and molecular weight 164.98 g/mol. IUPAC: ethyl 2-bromoethanimidate.
Chemical Property Profile of Ethyl bromoacetimidate
Property Insights of Ethyl bromoacetimidate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl bromoacetimidate. With a topological polar surface area (TPSA) of 33.1 Ų, Ethyl bromoacetimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl bromoacetimidate 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 Ethyl bromoacetimidate?
The CAS number of Ethyl bromoacetimidate is 930-70-1.
What is the molecular formula of Ethyl bromoacetimidate?
The molecular formula of Ethyl bromoacetimidate is C4H8BrNO.
What is the molecular weight of Ethyl bromoacetimidate?
The molecular weight of Ethyl bromoacetimidate is 164.98 g/mol.
Where can I buy Ethyl bromoacetimidate?
You can request a quote for Ethyl bromoacetimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl bromoacetimidate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl bromoacetimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.