4436-74-2
Product Name:
TRANS-2-BUTENE-1,4-DICARBOXYLIC ACID
Formula:
C6H8O4
Synonyms:
trans-3-Hexenedioic acid;2-Butene-1,4-dicarboxylic acid;Dihydromuconic acid
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | White crystalline solid; [Sigma-Aldrich MSDS] |
|---|---|
| Solubility | 17 mg/mL |
| Chemical Classes | Other Classes -> Organic Acids |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
| Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
| Molecular Weight | 144.12 g/mol |
|---|---|
| XLogP3 | -0.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 144.04225873 g/mol |
| Monoisotopic Mass | 144.04225873 g/mol |
| Topological Polar Surface Area | 74.6 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 141 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-hexenedioic acid is a hexenedioic acid where the C=C double bond is located at the 3-position.