1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer
TL;DR: 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer (CAS 76649-31-5) is a chemical compound with molecular formula C24H44O11 and molecular weight 508.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexane-1,6-diol;2-(hydroxymethyl)-2-methylpropane-1,3-diol
Also Known As: 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer, (C8-H6-O4.C6-H14-O2.C5-H12-O3.C5-H12-O2)x-, 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, 1,6-hexanediol and 2-(hydroxymethyl)-2-methyl-1,3-propanediol, benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; hexane-1,6-diol; 2-(hydroxymethyl)-2-methylpropane-1,3-diol
| Molecular Formula | C24H44O11 |
|---|---|
| Molecular Weight | 508.29 g/mol |
| LogP | 0.5812 |
| Topological Polar Surface Area | 216.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 508.28836 |
| Heavy Atoms | 35 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 76649-31-5 |
|---|---|
| SMILES | CC(C)(CO)CO.CC(CO)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO |
| InChIKey | GIQRZDSNTTXIPV-UHFFFAOYSA-N |
Product Overview
1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer (CAS 76649-31-5), with molecular formula C24H44O11 and molecular weight 508.29 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexane-1,6-diol;2-(hydroxymethyl)-2-methylpropane-1,3-diol.
Chemical Property Profile of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer
Property Insights of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer
The XLogP value of 0.5812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer. The TPSA of 216.0 Ų indicates high polarity, suggesting 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer has 9 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer?
The CAS number of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer is 76649-31-5.
What is the molecular formula of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer?
The molecular formula of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer is C24H44O11.
What is the molecular weight of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer?
The molecular weight of 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer is 508.29 g/mol.
Where can I buy 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer?
You can request a quote for 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Hexanediol, neopentyl glycol, isophthalic acid, trimethylolethane polymer and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.