But-3-en-1-yl carbonochloridate
TL;DR: But-3-en-1-yl carbonochloridate (CAS 88986-45-2) is a chemical compound with molecular formula C5H7ClO2 and molecular weight 134.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-3-enyl carbonochloridate
Also Known As: 3-Butenyl chloroformate, 3-butenylchloroformate, But-3-enyl Chloroformate, but-3-enyl carbonochloridate, but-3-en-1-yl carbonochloridate
| Molecular Formula | C5H7ClO2 |
|---|---|
| Molecular Weight | 134.01 g/mol |
| LogP | 1.9379 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 134.01346 |
| Heavy Atoms | 8 |
| Complexity | 90.42946 |
Chemical Identifiers
| CAS Number | 88986-45-2 |
|---|---|
| SMILES | C=CCCOC(=O)Cl |
Product Overview
But-3-en-1-yl carbonochloridate (CAS 88986-45-2), with molecular formula C5H7ClO2 and molecular weight 134.01 g/mol. IUPAC: but-3-enyl carbonochloridate.
Chemical Property Profile of But-3-en-1-yl carbonochloridate
Property Insights of But-3-en-1-yl carbonochloridate
The XLogP value of 1.9379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for But-3-en-1-yl carbonochloridate. With a topological polar surface area (TPSA) of 26.3 Ų, But-3-en-1-yl carbonochloridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, But-3-en-1-yl carbonochloridate has 0 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 But-3-en-1-yl carbonochloridate?
The CAS number of But-3-en-1-yl carbonochloridate is 88986-45-2.
What is the molecular formula of But-3-en-1-yl carbonochloridate?
The molecular formula of But-3-en-1-yl carbonochloridate is C5H7ClO2.
What is the molecular weight of But-3-en-1-yl carbonochloridate?
The molecular weight of But-3-en-1-yl carbonochloridate is 134.01 g/mol.
Where can I buy But-3-en-1-yl carbonochloridate?
You can request a quote for But-3-en-1-yl carbonochloridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for But-3-en-1-yl carbonochloridate?
Yes, KEHONG BIO provides custom synthesis services for But-3-en-1-yl carbonochloridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.