But-2-enoic acid

Base Information

• Chemical Name: But-2-enoic acid
• CAS No.: 113192-18-0
• Deprecated CAS: 15105-17-6
• Molecular Formula: C4H6O2
• DSSTox Substance ID: DTXSID7027544,DTXSID70764783
• Wikidata: Q27102269
• Metabolomics Workbench ID: 75582
• ChEMBL ID: CHEMBL3185203
• Mol file: 113192-18-0.mol

Synonyms:but-2-enoic acid;.alpha.-Crotonic acid;CH3CH=CHCOOH;DTXSID7027544;CHEBI:17217;Buta-1,2-diene-1,1-diol;113192-18-0;UN 2823;alpha-butenic acid;CHEMBL3185203;DTXSID70764783;LMFA01030925;AKOS028109915;FT-0624102;FT-0654375;Q27102269;39382-27-9

Chemical Property of But-2-enoic acid

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 86.036779430
• Heavy Atom Count: 6
• Complexity: 73.6

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CC(=O)O