Structure

4-(2,5-Dimethoxybenzoyl)benzoic acid

CAS
93012-66-9
Catalog Number
ACM93012669
Category
Other Products
Molecular Weight
286.28
Molecular Formula
C16H14O5

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Specification

Synonyms
CHEMBRDG-BB 4340319;4-(2,5-DIMETHOXY-BENZOYL)-BENZOIC ACID
What is the molecular formula of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The molecular formula is C16H14O5.

What is the molecular weight of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The molecular weight is 286.28 g/mol.

What is the IUPAC name of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The IUPAC name is 4-(2,5-dimethoxybenzoyl)benzoic acid.

What is the InChI code of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The InChI code is InChI=1S/C16H14O5/c1-20-12-7-8-14(21-2)13(9-12)15(17)10-3-5-11(6-4-10)16(18)19/h3-9H,1-2H3,(H,18,19).

What is the InChIKey of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The InChIKey is SFMJTPNGPIXLOL-UHFFFAOYSA-N.

What is the canonical SMILES representation of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The canonical SMILES representation is COC1=CC(=C(C=C1)OC)C(=O)C2=CC=C(C=C2)C(=O)O.

What is the CAS number of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The CAS number is 93012-66-9.

What is the ChEMBL ID of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The ChEMBL ID is CHEMBL1561470.

What is the XLogP3-AA value of 4-(2,5-Dimethoxybenzoyl)benzoic acid?

The XLogP3-AA value is 2.7.

Is 4-(2,5-Dimethoxybenzoyl)benzoic acid a canonicalized compound?

Yes, it is a canonicalized compound according to PubChem.

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