Oxirane, 2-butyl-2-(chloromethyl)-
TL;DR: Oxirane, 2-butyl-2-(chloromethyl)- (CAS 86488-91-7) is a chemical compound with molecular formula C7H13ClO and molecular weight 148.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-2-(chloromethyl)oxirane
Also Known As: 2-Butyl-2-(chloromethyl)oxirane, Oxirane, 2-butyl-2-(chloromethyl)-, 2-Butyl-2-(chloromethyl)oxirane #, (r,s)-2-butyl-2-chloromethyl-oxirane
| Molecular Formula | C7H13ClO |
|---|---|
| Molecular Weight | 148.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 148.06549 |
| Heavy Atoms | 9 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 86488-91-7 |
|---|---|
| SMILES | CCCCC1(CO1)CCl |
| InChIKey | GTNSGSPBQDPNNU-UHFFFAOYSA-N |
Product Overview
Oxirane, 2-butyl-2-(chloromethyl)- (CAS 86488-91-7), with molecular formula C7H13ClO and molecular weight 148.07 g/mol. IUPAC: 2-butyl-2-(chloromethyl)oxirane.
Chemical Property Profile of Oxirane, 2-butyl-2-(chloromethyl)-
Property Insights of Oxirane, 2-butyl-2-(chloromethyl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxirane, 2-butyl-2-(chloromethyl)-. With a topological polar surface area (TPSA) of 12.5 Ų, Oxirane, 2-butyl-2-(chloromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxirane, 2-butyl-2-(chloromethyl)- has 0 hydrogen bond donor(s) and 1 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 Oxirane, 2-butyl-2-(chloromethyl)-?
The CAS number of Oxirane, 2-butyl-2-(chloromethyl)- is 86488-91-7.
What is the molecular formula of Oxirane, 2-butyl-2-(chloromethyl)-?
The molecular formula of Oxirane, 2-butyl-2-(chloromethyl)- is C7H13ClO.
What is the molecular weight of Oxirane, 2-butyl-2-(chloromethyl)-?
The molecular weight of Oxirane, 2-butyl-2-(chloromethyl)- is 148.07 g/mol.
Where can I buy Oxirane, 2-butyl-2-(chloromethyl)-?
You can request a quote for Oxirane, 2-butyl-2-(chloromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxirane, 2-butyl-2-(chloromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Oxirane, 2-butyl-2-(chloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.