1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer
TL;DR: 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer (CAS 29295-79-2) is a chemical compound with molecular formula C23H36O12 and molecular weight 504.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzofuran-1,3-dione;butane-1,3-diol;hexanedioic acid;2-(hydroxymethyl)-2-methylpropane-1,3-diol
Also Known As: 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer, adipic acid; butane-1,3-diol; 2-(hydroxymethyl)-2-methyl-propane-1,3-diol; isobenzofuran-1,3-dione, (C8-H4-O3.C6-H10-O4.C5-H12-O3.C4-H10-O2)x-, Hexanedioic acid, polymer with 1,3-butanediol, 2-(hydroxymethyl)-2-methyl-1,3-propanediol and 1,3-isobenzofurandione, Trimethylolethane, phthalic anhydride, 1,3-butanediol, hexanedioxic acid polymer
| Molecular Formula | C23H36O12 |
|---|---|
| Molecular Weight | 504.22 g/mol |
| LogP | 0.4324 |
| Topological Polar Surface Area | 219.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 504.22067 |
| Heavy Atoms | 35 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 29295-79-2 |
|---|---|
| SMILES | CC(CCO)O.CC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O |
| InChIKey | NQLLQXHIROYKOH-UHFFFAOYSA-N |
Product Overview
1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer (CAS 29295-79-2), with molecular formula C23H36O12 and molecular weight 504.22 g/mol. IUPAC: 2-benzofuran-1,3-dione;butane-1,3-diol;hexanedioic acid;2-(hydroxymethyl)-2-methylpropane-1,3-diol.
Chemical Property Profile of 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer
Property Insights of 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer
The XLogP value of 0.4324 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer. The TPSA of 219.0 Ų indicates high polarity, suggesting 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer has 7 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 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer?
The CAS number of 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer is 29295-79-2.
What is the molecular formula of 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer?
The molecular formula of 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer is C23H36O12.
What is the molecular weight of 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer?
The molecular weight of 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer is 504.22 g/mol.
Where can I buy 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer?
You can request a quote for 1,3-Butanediol, phthalic anhydride, adipic 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 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Butanediol, phthalic anhydride, adipic acid, trimethylolethane polymer and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.