Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate
TL;DR: Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate (CAS 104133-71-3) is a chemical compound with molecular formula C29H40Na2O12S and molecular weight 658.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;formaldehyde;4-hydroxy-4-oxo-2-sulfobutanoate;4-nonylphenol;oxirane;benzoate
Also Known As: Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate, disodium;formaldehyde;4-hydroxy-4-oxo-2-sulfobutanoate;4-nonylphenol;oxirane;benzoate, (C15-H24-O.C2-H4-O.C-H2-O)x-.x-C7-H6-O2.x-C4-H6-O7-S.2Na, Formaldehyde, polymer with 4-nonylphenol and oxirane, benzoate hydrogen sulfobutanedioate, disodium, Formaldehyde, polymer with 4-nonylphenol and oxirane, benzoate hydrogen sulfobutanedioate, disodium salt
| Molecular Formula | C29H40Na2O12S |
|---|---|
| Molecular Weight | 658.20 g/mol |
| LogP | -3.9575 |
| Topological Polar Surface Area | 230.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 658.2036 |
| Heavy Atoms | 44 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 104133-71-3 |
|---|---|
| SMILES | CCCCCCCCCC1=CC=C(C=C1)O.C=O.C1CO1.C1=CC=C(C=C1)C(=O)[O-].C(C(C(=O)[O-])S(=O)(=O)O)C(=O)O.[Na+].[Na+] |
| InChIKey | VCCOJJWYQYABBJ-UHFFFAOYSA-L |
Product Overview
Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate (CAS 104133-71-3), with molecular formula C29H40Na2O12S and molecular weight 658.20 g/mol. IUPAC: disodium;formaldehyde;4-hydroxy-4-oxo-2-sulfobutanoate;4-nonylphenol;oxirane;benzoate.
Chemical Property Profile of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate
Property Insights of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate
The XLogP value of -3.9575 indicates that Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 230.0 Ų indicates high polarity, suggesting Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate?
The CAS number of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate is 104133-71-3.
What is the molecular formula of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate?
The molecular formula of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate is C29H40Na2O12S.
What is the molecular weight of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate?
The molecular weight of Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate is 658.20 g/mol.
Where can I buy Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate?
You can request a quote for Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate?
Yes, KEHONG BIO provides custom synthesis services for Disodium; Formaldehyde; 4-hydroxy-4-oxo-2-sulfo-butanoate; 4-nonylphenol; Oxirane; Benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.