Borinic acid, dipropylthio-, 3-chlorophenyl ester
TL;DR: Borinic acid, dipropylthio-, 3-chlorophenyl ester (CAS 64541-68-0) is a chemical compound with molecular formula C12H18BClS and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chlorophenyl)sulfanyl-dipropylborane
Also Known As: (3-chlorophenyl)sulfanyl-dipropylborane, Borinic acid, dipropylthio-, 3-chlorophenyl ester, Borinic acid,dipropylthio-3-chlorophenyl ester, [(3-Chlorophenyl)sulfanyl]di(propyl)borane
| Molecular Formula | C12H18BClS |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 5.2436 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.09108 |
| Heavy Atoms | 15 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 64541-68-0 |
|---|---|
| SMILES | B(CCC)(CCC)SC1=CC(=CC=C1)Cl |
| InChIKey | ITBFKMQWTNKHTI-UHFFFAOYSA-N |
Product Overview
Borinic acid, dipropylthio-, 3-chlorophenyl ester (CAS 64541-68-0), with molecular formula C12H18BClS and molecular weight 240.09 g/mol. IUPAC: (3-chlorophenyl)sulfanyl-dipropylborane.
Chemical Property Profile of Borinic acid, dipropylthio-, 3-chlorophenyl ester
Property Insights of Borinic acid, dipropylthio-, 3-chlorophenyl ester
The XLogP value of 5.2436 indicates that Borinic acid, dipropylthio-, 3-chlorophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Borinic acid, dipropylthio-, 3-chlorophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Borinic acid, dipropylthio-, 3-chlorophenyl ester has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Borinic acid, dipropylthio-, 3-chlorophenyl ester?
The CAS number of Borinic acid, dipropylthio-, 3-chlorophenyl ester is 64541-68-0.
What is the molecular formula of Borinic acid, dipropylthio-, 3-chlorophenyl ester?
The molecular formula of Borinic acid, dipropylthio-, 3-chlorophenyl ester is C12H18BClS.
What is the molecular weight of Borinic acid, dipropylthio-, 3-chlorophenyl ester?
The molecular weight of Borinic acid, dipropylthio-, 3-chlorophenyl ester is 240.09 g/mol.
Where can I buy Borinic acid, dipropylthio-, 3-chlorophenyl ester?
You can request a quote for Borinic acid, dipropylthio-, 3-chlorophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Borinic acid, dipropylthio-, 3-chlorophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Borinic acid, dipropylthio-, 3-chlorophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.