CTK1H3123
TL;DR: CTK1H3123 (CAS 58048-89-8) is a chemical compound with molecular formula C27H40O6 and molecular weight 460.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-methylprop-2-enoate;butyl prop-2-enoate;2-methylprop-2-enoic acid;styrene
Also Known As: (C8-H14-O2.C8-H8.C7-H12-O2.C4-H6-O2)x-, Styrene, methacrylic acid, butyl methacrylate, butyl acrylate polymer, butyl 2-methylprop-2-enoate; butyl prop-2-enoate; 2-methylprop-2-enoic acid; styrene, Methacrylic acid butyl methacrylate butyl acrylate styrene polymer, 2-Propenoic acid, 2-methyl-, polymer with butyl 2-methyl-2-propenoate, butyl 2-propenoate and ethenylbenzene
| Molecular Formula | C27H40O6 |
|---|---|
| Molecular Weight | 460.28 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 460.2825 |
| Heavy Atoms | 33 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 58048-89-8 |
|---|---|
| SMILES | CCCCOC(=O)C=C.CCCCOC(=O)C(=C)C.CC(=C)C(=O)O.C=CC1=CC=CC=C1 |
| InChIKey | DJSPRJNMABCKGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CTK1H3123 (CAS 58048-89-8), with molecular formula C27H40O6 and molecular weight 460.28 g/mol. IUPAC: butyl 2-methylprop-2-enoate;butyl prop-2-enoate;2-methylprop-2-enoic acid;styrene.
Chemical Property Profile of CTK1H3123
Property Insights of CTK1H3123
The XLogP value of 6.4 indicates that CTK1H3123 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK1H3123. Following Lipinski's Rule of Five, CTK1H3123 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK1H3123?
The CAS number of CTK1H3123 is 58048-89-8.
What is the molecular formula of CTK1H3123?
The molecular formula of CTK1H3123 is C27H40O6.
What is the molecular weight of CTK1H3123?
The molecular weight of CTK1H3123 is 460.28 g/mol.
Where can I buy CTK1H3123?
You can request a quote for CTK1H3123 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK1H3123?
Yes, KEHONG BIO provides custom synthesis services for CTK1H3123 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.