Tetrakis(4-carboxyphenyl)ethylene

C₃₀H₂₀O₈CAS 1351279-73-6508.48 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid

Properties

Molecular formula: C₃₀H₂₀O₈
Molar mass: 508.48 g/mol
Exact mass: 508.1158 Da
logP: 5.49Crippen estimate
Polar surface area: 149.2 Å²
H-bond donors / acceptors: 4 / 4
Rotatable bonds: 8

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

1351279-73-6

SMILES

C1=CC(=CC=C1C(=C(C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)C(=O)O)C(=O)O

InChIKey

MPYOMTPWHUPLKU-UHFFFAOYSA-N

InChI

InChI=1S/C30H20O8/c31-27(32)21-9-1-17(2-10-21)25(18-3-11-22(12-4-18)28(33)34)26(19-5-13-23(14-6-19)29(35)36)20-7-15-24(16-8-20)30(37)38/h1-16H,(H,31,32)(H,33,34)(H,35,36)(H,37,38)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

1,1,2,2-Tetra(4-carboxylphenyl)ethylene

Work with Tetrakis(4-carboxyphenyl)ethylene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4',4'',4''',4''''-(Ethene-1,1,2,2-tetrayl)tetrabiphenyl-4-carboxylic acid1610858-96-286 % similar Terephthalic acid100-21-083 % similar 4-(1,2,2-Triphenyl vinyl)benzoic acid197153-87-082 % similar [P-Terphenyl]-4,4''-dicarboxylic acid13653-84-471 % similar [1,1′-Biphenyl]-4,4′-dicarboxylic acid787-70-271 % similar 4,4′-Oxybis[benzoic acid]2215-89-665 % similar 4-Hydroxybenzoic acid99-96-765 % similar Benzoic acid65-85-064 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook