Isopropylidene-succinic acid
TL;DR: Isopropylidene-succinic acid (CAS 584-27-0) is a chemical compound with molecular formula C7H10O4 and molecular weight 158.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-ylidenebutanedioic acid
Also Known As: Teraconsaeure, Teraconsaure, teraconic acid, Isopropylidene-succinic acid, 4,4-DIMETHYL ITACONIC ACID
| Molecular Formula | C7H10O4 |
|---|---|
| Molecular Weight | 158.06 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 158.0579 |
| Heavy Atoms | 11 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 584-27-0 |
|---|---|
| SMILES | CC(=C(CC(=O)O)C(=O)O)C |
| InChIKey | GYXGAEAOIFNGAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropylidene-succinic acid (CAS 584-27-0), with molecular formula C7H10O4 and molecular weight 158.06 g/mol. IUPAC: 2-propan-2-ylidenebutanedioic acid.
Chemical Property Profile of Isopropylidene-succinic acid
Property Insights of Isopropylidene-succinic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylidene-succinic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropylidene-succinic acid. Following Lipinski's Rule of Five, Isopropylidene-succinic acid 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 Isopropylidene-succinic acid?
The CAS number of Isopropylidene-succinic acid is 584-27-0.
What is the molecular formula of Isopropylidene-succinic acid?
The molecular formula of Isopropylidene-succinic acid is C7H10O4.
What is the molecular weight of Isopropylidene-succinic acid?
The molecular weight of Isopropylidene-succinic acid is 158.06 g/mol.
Where can I buy Isopropylidene-succinic acid?
You can request a quote for Isopropylidene-succinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropylidene-succinic acid?
Yes, KEHONG BIO provides custom synthesis services for Isopropylidene-succinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.