The synonyms of the compound are: 97852-94-3 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-2-mercapto- 3-(3,4-Dimethoxyphenyl)-2-mercaptoacrylic acid SCHEMBL9130918 (Z)-3-(3,4-dimethoxyphenyl)-2-sulfanylprop-2-enoic acid
What is the molecular weight of the compound?
The molecular weight of the compound is 240.28 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is (Z)-3-(3,4-dimethoxyphenyl)-2-sulfanylprop-2-enoic acid.
What is the InChIKey of the compound?
The InChIKey of the compound is CBSSDYIFWLVFGD-POHAHGRESA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is COC1=C(C=C(C=C1)C=C(C(=O)O)S)OC.
What is the CAS number of the compound?
The CAS number of the compound is 97852-94-3.
What is the XLogP3 value of the compound?
The XLogP3 value of the compound is 1.8.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
How many rotatable bond counts does the compound have?
The compound has 4 rotatable bond counts.
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