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Piperonylic acid (C8H6O4)

Piperonylic Acid presents a C8 framework, aromatic rings, a carboxylic acid (formula C8H6O4, CAS 94-53-1). ChemicalTool Reaction can propose ranked disconnections for Piperonylic Acid from the SMILES O=C(O)c1ccc2c(c1)OCO2.

Target
Piperonylic acid
CAS
94-53-1
Formula
C8H6O4
Approx. MW
166.13
SMILES
O=C(O)c1ccc2c(c1)OCO2
PubChem CID
7196
Approx. carbons
C8

Piperonylic acid structure

Properties

IUPAC name
1,3-benzodioxole-5-carboxylic acid
Common names
PIPERONYLIC ACID; 94-53-1; 1,3-Benzodioxole-5-carboxylic acid; Heliotropic acid; 2H-1,3-Benzodioxole-5-Carboxylic Acid; 3,4-(Methylenedioxy)benzoic acid; Protocatechuic acid methylene ether; 5-Benzodioxolecarboxylic acid; 3,4-Dioxymethylenebenzoic acid; QX3V1NO0KH
Molecular weight
166.13
Exact mass
166.03
InChIKey
VDVJGIYXDVPQLP-UHFFFAOYSA-N
Melting point
229 °C

View on PubChem

Piperonylic acid 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Piperonylic acid?

Piperonylic acid has molecular formula C8H6O4. Molecular weight about 166.13 g·mol⁻¹.

What is the CAS number of Piperonylic acid?

The CAS Registry Number for Piperonylic acid is 94-53-1.

Run AI retrosynthesis for Piperonylic acid Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C8H6O4.

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3-Formylsalicylic acid5-Formylsalicylic acidIsophthalic Acidphthalic acid2-(4-Fluorophenyl)acetic acid2-amino-2-(4-hydroxyphenyl)acetic acid

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References & tools