Allyl tert-butyl peroxycarbonate
TL;DR: Allyl tert-butyl peroxycarbonate (CAS 65700-08-5) is a chemical compound with molecular formula C8H14O4 and molecular weight 174.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl prop-2-enoxy carbonate
Also Known As: Allyl tert-butyl peroxycarbonate, tert-butyl prop-2-enoxy carbonate, EINECS 265-881-8, chlorophenylmethyldichlorosilane, tert-butylperoxy allyl carbonate
| Molecular Formula | C8H14O4 |
|---|---|
| Molecular Weight | 174.09 g/mol |
| LogP | 2.0557 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.0892 |
| Heavy Atoms | 12 |
| Complexity | 156.93102 |
Chemical Identifiers
| CAS Number | 65700-08-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)OOCC=C |
Product Overview
Allyl tert-butyl peroxycarbonate (CAS 65700-08-5), with molecular formula C8H14O4 and molecular weight 174.09 g/mol. IUPAC: tert-butyl prop-2-enoxy carbonate.
Chemical Property Profile of Allyl tert-butyl peroxycarbonate
Property Insights of Allyl tert-butyl peroxycarbonate
The XLogP value of 2.0557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allyl tert-butyl peroxycarbonate. With a topological polar surface area (TPSA) of 44.76 Ų, Allyl tert-butyl peroxycarbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl tert-butyl peroxycarbonate 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 Allyl tert-butyl peroxycarbonate?
The CAS number of Allyl tert-butyl peroxycarbonate is 65700-08-5.
What is the molecular formula of Allyl tert-butyl peroxycarbonate?
The molecular formula of Allyl tert-butyl peroxycarbonate is C8H14O4.
What is the molecular weight of Allyl tert-butyl peroxycarbonate?
The molecular weight of Allyl tert-butyl peroxycarbonate is 174.09 g/mol.
Where can I buy Allyl tert-butyl peroxycarbonate?
You can request a quote for Allyl tert-butyl peroxycarbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl tert-butyl peroxycarbonate?
Yes, KEHONG BIO provides custom synthesis services for Allyl tert-butyl peroxycarbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.