Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite
TL;DR: Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite (CAS 80348-62-5) is a chemical compound with molecular formula C7H11ClNa2O6S and molecular weight 303.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite
Also Known As: 2-Butyne-1,4-diol, reaction products with epichlorohydrin and sodium sulfite, disodium; but-2-yne-1,4-diol; 2-(chloromethyl)oxirane; sulfite
| Molecular Formula | C7H11ClNa2O6S |
|---|---|
| Molecular Weight | 303.98 g/mol |
| LogP | -7.3977 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 303.976 |
| Heavy Atoms | 17 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 80348-62-5 |
|---|---|
| SMILES | C1C(O1)CCl.C(C#CCO)O.[O-]S(=O)[O-].[Na+].[Na+] |
| InChIKey | MVTDDXQWUDOJIM-UHFFFAOYSA-L |
Product Overview
Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite (CAS 80348-62-5), with molecular formula C7H11ClNa2O6S and molecular weight 303.98 g/mol. IUPAC: disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite.
Chemical Property Profile of Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite
Property Insights of Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite
The XLogP value of -7.3977 indicates that Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite. Following Lipinski's Rule of Five, Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite has 2 hydrogen bond donor(s) and 7 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 Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite?
The CAS number of Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite is 80348-62-5.
What is the molecular formula of Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite?
The molecular formula of Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite is C7H11ClNa2O6S.
What is the molecular weight of Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite?
The molecular weight of Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite is 303.98 g/mol.
Where can I buy Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite?
You can request a quote for Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite?
Yes, KEHONG BIO provides custom synthesis services for Disodium;but-2-yne-1,4-diol;2-(chloromethyl)oxirane;sulfite and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.