(C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-
TL;DR: (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- (CAS 42767-92-0) is a chemical compound with molecular formula C25H36O7 and molecular weight 448.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl prop-2-enoate;2-hydroxyethyl prop-2-enoate;methyl 2-methylprop-2-enoate;styrene
Also Known As: (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-, Butyl Prop-2-enoate; 2-hydroxyethyl Prop-2-enoate; Methyl 2-methylprop-2-enoate; Styrene, 2-Propenoic acid, 2-methyl-, methyl ester, polymer with butyl 2-propenoate, ethenylbenzene and 2-hydroxyethyl 2-propenoate
| Molecular Formula | C25H36O7 |
|---|---|
| Molecular Weight | 448.25 g/mol |
| LogP | 4.2887 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 448.2461 |
| Heavy Atoms | 32 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 42767-92-0 |
|---|---|
| SMILES | CCCCOC(=O)C=C.CC(=C)C(=O)OC.C=CC1=CC=CC=C1.C=CC(=O)OCCO |
| InChIKey | DOQMXRDUBUHMLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- (CAS 42767-92-0), with molecular formula C25H36O7 and molecular weight 448.25 g/mol. IUPAC: butyl prop-2-enoate;2-hydroxyethyl prop-2-enoate;methyl 2-methylprop-2-enoate;styrene.
Chemical Property Profile of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-
Property Insights of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-
The XLogP value of 4.2887 indicates that (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-. Following Lipinski's Rule of Five, (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-?
The CAS number of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- is 42767-92-0.
What is the molecular formula of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-?
The molecular formula of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- is C25H36O7.
What is the molecular weight of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-?
The molecular weight of (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- is 448.25 g/mol.
Where can I buy (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-?
You can request a quote for (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C8-H8.C7-H12-O2.C5-H8-O3.C5-H8-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.