5-Chlorovanillic acid

Catalog Number
ACMA00002764
Category
Ethers
Molecular Weight
202.59
Molecular Formula
C8H7ClO3

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Specification

Hazard Statements
H302
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the PubChem CID of 5-Chlorovanillic acid?

PubChem CID 44215.

What is the molecular formula of 5-Chlorovanillic acid?

The molecular formula is C8H7ClO4.

What is the molecular weight of 5-Chlorovanillic acid?

The molecular weight is 202.59 g/mol.

What are the synonyms of 5-Chlorovanillic acid?

The synonyms are 62936-23-6, 3-CHLORO-4-HYDROXY-5-METHOXYBENZOIC ACID, 5-CHLOROVANILLIC ACID, Benzoic acid, 3-chloro-4-hydroxy-5-methoxy-, and MFCD00016531.

When was 5-Chlorovanillic acid created in PubChem?

It was created on March 26, 2005.

When was 5-Chlorovanillic acid last modified in PubChem?

It was last modified on November 25, 2023.

What is the IUPAC name of 5-Chlorovanillic acid?

The IUPAC name is 3-chloro-4-hydroxy-5-methoxybenzoic acid.

What is the InChI of 5-Chlorovanillic acid?

The InChI is InChI=1S/C8H7ClO4/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,10H,1H3,(H,11,12).

What is the InChIKey of 5-Chlorovanillic acid?

The InChIKey is XBRYEHVBBMSSCG-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Chlorovanillic acid?

The canonical SMILES is COC1=C(C(=CC(=C1)C(=O)O)Cl)O.

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