1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid
TL;DR: 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid (CAS 103004-27-9) is a chemical compound with molecular formula C57H80O23 and molecular weight 1132.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-dicarboxylic acid;2-benzofuran-1,3-dione;butyl prop-2-enoate;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanedioic acid;hexane-1,6-diol;2-hydroxyethyl prop-2-enoate;prop-2-enoic acid;styrene
Also Known As: 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid, (C8-H8.C8-H6-O4.C8-H4-O3.C7-H12-O2.C6-H14-O3.C6-H14-O2.C6-H10-O4.C5-H8-O3.C3-H4-O2)x-, 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenic acid, 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate,1,3-isobenzofurandione and 2-propenoic acid, benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; butyl prop-2-enoate; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; hexane-1,6-diol; 2-hydroxyethyl prop-2-enoate; prop-2-enoic acid; styrene
| Molecular Formula | C57H80O23 |
|---|---|
| Molecular Weight | 1132.51 g/mol |
| LogP | 6.4975 |
| Topological Polar Surface Area | 404.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 27 |
| Exact Mass | 1132.509 |
| Heavy Atoms | 80 |
| Complexity | 881.0 |
Chemical Identifiers
| CAS Number | 103004-27-9 |
|---|---|
| SMILES | CCCCOC(=O)C=C.CCC(CO)(CO)CO.C=CC1=CC=CC=C1.C=CC(=O)O.C=CC(=O)OCCO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O |
| InChIKey | KESWMSNEXFVSOP-UHFFFAOYSA-N |
Product Overview
1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid (CAS 103004-27-9), with molecular formula C57H80O23 and molecular weight 1132.51 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2-benzofuran-1,3-dione;butyl prop-2-enoate;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanedioic acid;hexane-1,6-diol;2-hydroxyethyl prop-2-enoate;prop-2-enoic acid;styrene.
Chemical Property Profile of 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid
Property Insights of 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid
The XLogP value of 6.4975 indicates that 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 404.0 Ų indicates high polarity, suggesting 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid has 11 hydrogen bond donor(s) and 23 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-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid?
The CAS number of 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid is 103004-27-9.
What is the molecular formula of 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid?
The molecular formula of 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid is C57H80O23.
What is the molecular weight of 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid?
The molecular weight of 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid is 1132.51 g/mol.
Where can I buy 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid?
You can request a quote for 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedicarboxylic acid, polymer with butyl 2-propenoate, ethenylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 2-hydroxyethyl 2-propenoate, 1,3-isobenzofurandione and 2-propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.