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] |
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Solubility | 17 mg/mL |
Chemical Classes | Other Classes -> Organic Acids |
SAFETY INFORMATION
Signal word | Warning |
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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 |
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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.