(1-Chloroethylideneamino) ethyl carbonate
TL;DR: (1-Chloroethylideneamino) ethyl carbonate (CAS 127080-01-7) is a chemical compound with molecular formula C5H8ClNO3 and molecular weight 165.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-chloroethylideneamino) ethyl carbonate
Also Known As: [(Z)-1-chloroethylideneamino] ethyl carbonate
| Molecular Formula | C5H8ClNO3 |
|---|---|
| Molecular Weight | 165.02 g/mol |
| LogP | 1.7317 |
| Topological Polar Surface Area | 47.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.01927 |
| Heavy Atoms | 10 |
| Complexity | 141.82849 |
Chemical Identifiers
| CAS Number | 127080-01-7 |
|---|---|
| SMILES | CCOC(=O)ON=C(C)Cl |
Product Overview
(1-Chloroethylideneamino) ethyl carbonate (CAS 127080-01-7), with molecular formula C5H8ClNO3 and molecular weight 165.02 g/mol. IUPAC: (1-chloroethylideneamino) ethyl carbonate.
Chemical Property Profile of (1-Chloroethylideneamino) ethyl carbonate
Property Insights of (1-Chloroethylideneamino) ethyl carbonate
The XLogP value of 1.7317 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Chloroethylideneamino) ethyl carbonate. With a topological polar surface area (TPSA) of 47.89 Ų, (1-Chloroethylideneamino) ethyl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Chloroethylideneamino) ethyl carbonate has 0 hydrogen bond donor(s) and 4 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 (1-Chloroethylideneamino) ethyl carbonate?
The CAS number of (1-Chloroethylideneamino) ethyl carbonate is 127080-01-7.
What is the molecular formula of (1-Chloroethylideneamino) ethyl carbonate?
The molecular formula of (1-Chloroethylideneamino) ethyl carbonate is C5H8ClNO3.
What is the molecular weight of (1-Chloroethylideneamino) ethyl carbonate?
The molecular weight of (1-Chloroethylideneamino) ethyl carbonate is 165.02 g/mol.
Where can I buy (1-Chloroethylideneamino) ethyl carbonate?
You can request a quote for (1-Chloroethylideneamino) ethyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Chloroethylideneamino) ethyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for (1-Chloroethylideneamino) ethyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.