2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate
TL;DR: 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate (CAS 35128-51-9) is a chemical compound with molecular formula C8H12Cl2O4 and molecular weight 242.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyloxy-1,4-dichlorobutan-2-yl) acetate
Also Known As: 1,4-dichlorobutane-2,3-diyl diacetate, 2,3-Butanediol, 1,4-dichloro-, diacetate, 2,3-Diacetoxy-1,4-dichlor-butan, 2,3-diacetoxy-1,4-dichloro-butane, 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate
| Molecular Formula | C8H12Cl2O4 |
|---|---|
| Molecular Weight | 242.01 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 242.01126 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 35128-51-9 |
|---|---|
| SMILES | CC(=O)OC(CCl)C(CCl)OC(=O)C |
| InChIKey | VUSDDVVGSXTTKL-UHFFFAOYSA-N |
Product Overview
2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate (CAS 35128-51-9), with molecular formula C8H12Cl2O4 and molecular weight 242.01 g/mol. IUPAC: (3-acetyloxy-1,4-dichlorobutan-2-yl) acetate.
Chemical Property Profile of 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate
Property Insights of 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate. With a topological polar surface area (TPSA) of 52.6 Ų, 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate 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 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate?
The CAS number of 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate is 35128-51-9.
What is the molecular formula of 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate?
The molecular formula of 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate is C8H12Cl2O4.
What is the molecular weight of 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate?
The molecular weight of 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate is 242.01 g/mol.
Where can I buy 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate?
You can request a quote for 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Butanediol, 1,4-dichloro-, 2,3-diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.