Dibutyl(chloromethyl)boronate
TL;DR: Dibutyl(chloromethyl)boronate (CAS 88328-38-5) is a chemical compound with molecular formula C9H20BClO2 and molecular weight 206.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibutoxy(chloromethyl)borane
Also Known As: dibutyl(chloromethyl)boronate, dibutoxy(chloromethyl)borane, dibutyl (chloromethyl)boronate
| Molecular Formula | C9H20BClO2 |
|---|---|
| Molecular Weight | 206.12 g/mol |
| LogP | 2.886 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 206.12448 |
| Heavy Atoms | 13 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 88328-38-5 |
|---|---|
| SMILES | B(CCl)(OCCCC)OCCCC |
| InChIKey | NTQGCMBNQMYBDY-UHFFFAOYSA-N |
Product Overview
Dibutyl(chloromethyl)boronate (CAS 88328-38-5), with molecular formula C9H20BClO2 and molecular weight 206.12 g/mol. IUPAC: dibutoxy(chloromethyl)borane.
Chemical Property Profile of Dibutyl(chloromethyl)boronate
Property Insights of Dibutyl(chloromethyl)boronate
The XLogP value of 2.886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibutyl(chloromethyl)boronate. With a topological polar surface area (TPSA) of 18.5 Ų, Dibutyl(chloromethyl)boronate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibutyl(chloromethyl)boronate 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 Dibutyl(chloromethyl)boronate?
The CAS number of Dibutyl(chloromethyl)boronate is 88328-38-5.
What is the molecular formula of Dibutyl(chloromethyl)boronate?
The molecular formula of Dibutyl(chloromethyl)boronate is C9H20BClO2.
What is the molecular weight of Dibutyl(chloromethyl)boronate?
The molecular weight of Dibutyl(chloromethyl)boronate is 206.12 g/mol.
Where can I buy Dibutyl(chloromethyl)boronate?
You can request a quote for Dibutyl(chloromethyl)boronate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibutyl(chloromethyl)boronate?
Yes, KEHONG BIO provides custom synthesis services for Dibutyl(chloromethyl)boronate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.