2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol
TL;DR: 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol (CAS 82785-46-4) is a chemical compound with molecular formula C17H36O8 and molecular weight 368.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol
Also Known As: Hexanedioic acid, polymer with 2,2-dimethyl-1,3-propanediol and 1,6-hexanediol, Hexanediol, neopentyl glycol, adipic acid polymer, poly(1,6-hexanediol/neopentyl glycol-alt-adipic acid), 2,2-dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol, 1,6-Hexanediol, neopentyl glycol, adipic acid polyester
| Molecular Formula | C17H36O8 |
|---|---|
| Molecular Weight | 368.24 g/mol |
| LogP | 1.2446 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 368.24103 |
| Heavy Atoms | 25 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 82785-46-4 |
|---|---|
| SMILES | CC(C)(CO)CO.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O |
| InChIKey | HNIBILYKBWAIPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol (CAS 82785-46-4), with molecular formula C17H36O8 and molecular weight 368.24 g/mol. IUPAC: 2,2-dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol.
Chemical Property Profile of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol
Property Insights of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol
The XLogP value of 1.2446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol. The TPSA of 156.0 Ų indicates high polarity, suggesting 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol?
The CAS number of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol is 82785-46-4.
What is the molecular formula of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol?
The molecular formula of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol is C17H36O8.
What is the molecular weight of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol?
The molecular weight of 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol is 368.24 g/mol.
Where can I buy 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol?
You can request a quote for 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethylpropane-1,3-diol;hexanedioic acid;hexane-1,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.