buta-1,3-diene;(E)-but-2-enedioic acid;prop-2-enoic acid;styrene

Base Information

• Chemical Name: buta-1,3-diene;(E)-but-2-enedioic acid;prop-2-enoic acid;styrene
• CAS No.: 26007-18-1
• Molecular Formula: C19H22O6
• Molecular Weight: 346.37438
• Mol file: 26007-18-1.mol

Synonyms:26007-18-1;(C8-H8.C4-H6.C4-H4-O4.C3-H4-O2)x-

Chemical Property of buta-1,3-diene;(E)-but-2-enedioic acid;prop-2-enoic acid;styrene

Chemical Property:

• Boiling Point: 145.2°Cat760mmHg
• Flash Point: 31.1°C
• PSA: 111.90000
• Density: g/cm³
• LogP: 3.65680
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 346.14163842
• Heavy Atom Count: 25
• Complexity: 264

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CC=C.C=CC1=CC=CC=C1.C=CC(=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C=CC=C.C=CC1=CC=CC=C1.C=CC(=O)O.C(=C/C(=O)O)\C(=O)O