2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)
TL;DR: 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) (CAS 65379-39-7) is a chemical compound with molecular formula C13H20O6 and molecular weight 272.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-methylprop-2-enoate;2-methylidenebutanedioic acid
Also Known As: Butyl methacrylate, itaconic acid polymer, (C8-H14-O2.C5-H6-O4)x-, Methacrylic acid, butyl ester, itaconic acid polymer, Butanedioic acid, methylene-, polymer with butyl 2-methyl-2-propenoate, butyl 2-methylprop-2-enoate; 2-methylidenebutanedioic acid
| Molecular Formula | C13H20O6 |
|---|---|
| Molecular Weight | 272.13 g/mol |
| LogP | 2.0077 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 272.12598 |
| Heavy Atoms | 19 |
| Complexity | 356.14493 |
Chemical Identifiers
| CAS Number | 65379-39-7 |
|---|---|
| SMILES | CCCCOC(=O)C(=C)C.C=C(CC(=O)O)C(=O)O |
Product Overview
2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) (CAS 65379-39-7), with molecular formula C13H20O6 and molecular weight 272.13 g/mol. IUPAC: butyl 2-methylprop-2-enoate;2-methylidenebutanedioic acid.
Chemical Property Profile of 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)
Property Insights of 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)
The XLogP value of 2.0077 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1). The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1). Following Lipinski's Rule of Five, 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) has 2 hydrogen bond donor(s) and 4 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 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)?
The CAS number of 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) is 65379-39-7.
What is the molecular formula of 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)?
The molecular formula of 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) is C13H20O6.
What is the molecular weight of 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)?
The molecular weight of 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) is 272.13 g/mol.
Where can I buy 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)?
You can request a quote for 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylidenebutanedioic acid--butyl 2-methylprop-2-enoate (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.