巴豆酸酐
TL;DR: 巴豆酸酐 (CAS 78957-07-0) is a chemical compound with molecular formula C8H10O3 and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
巴豆酸酐
[(E)-but-2-enoyl] (E)-but-2-enoate
Also Known As: CROTONIC ANHYDRIDE, But-2-enoic anhydride, 2-Butenoic anhydride, Crotonic acid anhydride, Crotonicanhydride
| Molecular Formula | C8H10O3 |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | 1.2084 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.06299 |
| Heavy Atoms | 11 |
| Complexity | 179.3827 |
Chemical Identifiers
| CAS Number | 78957-07-0 |
|---|---|
| SMILES | C/C=C/C(=O)OC(=O)/C=C/C |
Product Overview
巴豆酸酐 (CAS 78957-07-0), with molecular formula C8H10O3 and molecular weight 154.06 g/mol. IUPAC: [(E)-but-2-enoyl] (E)-but-2-enoate.
Chemical Property Profile of 巴豆酸酐
Property Insights of 巴豆酸酐
The XLogP value of 1.2084 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 巴豆酸酐. With a topological polar surface area (TPSA) of 43.37 Ų, 巴豆酸酐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 巴豆酸酐 has 0 hydrogen bond donor(s) and 3 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 巴豆酸酐?
The CAS number of 巴豆酸酐 is 78957-07-0.
What is the molecular formula of 巴豆酸酐?
The molecular formula of 巴豆酸酐 is C8H10O3.
What is the molecular weight of 巴豆酸酐?
The molecular weight of 巴豆酸酐 is 154.06 g/mol.
Where can I buy 巴豆酸酐?
You can request a quote for 巴豆酸酐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 巴豆酸酐?
Yes, KEHONG BIO provides custom synthesis services for 巴豆酸酐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.