RDH

3-[(1-Carboxyvinyl)oxy]benzoic acid

Created: 2020-09-25
Last modified:  2021-10-06

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Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count0
Bond Count23
Aromatic Bond Count6
2D diagram of RDH

Chemical Component Summary

Name3-[(1-Carboxyvinyl)oxy]benzoic acid
Synonyms3-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)oxybenzoic acid
Systematic Name (OpenEye OEToolkits)3-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)oxybenzoic acid
FormulaC10 H8 O5
Molecular Weight208.168
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385OC(=O)C(=C)Oc1cccc(c1)C(O)=O
SMILESOpenEye OEToolkits2.0.7C=C(C(=O)O)Oc1cccc(c1)C(=O)O
Canonical SMILESCACTVS3.385 OC(=O)C(=C)Oc1cccc(c1)C(O)=O
Canonical SMILESOpenEye OEToolkits2.0.7 C=C(C(=O)O)Oc1cccc(c1)C(=O)O
InChIInChI1.03 InChI=1S/C10H8O5/c1-6(9(11)12)15-8-4-2-3-7(5-8)10(13)14/h2-5H,1H2,(H,11,12)(H,13,14)
InChIKeyInChI1.03 HGVAHYJMDVROLE-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 23844017
ChEBI CHEBI:77107