Aconitic acid, TMS

Base Information

• Chemical Name: Aconitic acid, TMS
• CAS No.: 55530-71-7
• Molecular Weight: 390.65
• DSSTox Substance ID: DTXSID401347132
• Nikkaji Number: J45.474E
• Wikidata: Q63399255
• Mol file: 55530-71-7.mol

Synonyms:Aconitic acid, TMS;55530-71-7;Aconitic acid, tri-TMS;trans-Aconitic acid (tms);cis-Aconitic acid (3TMS);Tris(trimethylsilyl) (1Z)-1-propene-1,2,3-tricarboxylate #;(Z)-Aconitic acid, tris-TMS;1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (Z)-;RHDPKJMZPKZKTA-BENRWUELSA-N;RHDPKJMZPKZKTA-UHFFFAOYSA-N;DTXSID401347132;Aconitic acid, (Z)-, 3TMS derivative;cis-Aconitic acid, tris(trimethylsilyl) ester;Q63399255;(Z)-1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester;(Z)-1-Propene-1,2,3-tris(carboxylic acid trimethylsilyl) ester;CIS-1-PROPENE-1,2,3-TRICARBOXYLIC ACID TRI(TRIMETHYLSILYL) ESTER

Chemical Property of Aconitic acid, TMS

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 390.13501828
• Heavy Atom Count: 24
• Complexity: 521

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C[Si](C)(C)OC(=O)CC(=CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
• Isomeric SMILES: C[Si](C)(C)OC(=O)C/C(=C/C(=O)O[Si](C)(C)C)/C(=O)O[Si](C)(C)C