Methyl benzo[d][1,3]dioxole-4-carboxylate structure

Methyl benzo[d][1,3]dioxole-4-carboxylate

methyl 1,3-benzodioxole-4-carboxylate

Also Known As: methyl benzo[d][1,3]dioxole-4-carboxylate|methyl 1,3-benzodioxole-4-carboxylate|methyl 2H-1,3-benzodioxole-4-carboxylate|Methyl1,3-benzodioxole-4-carboxylate|KS-00000BC7|methyl 1,3-benzodioxol-4-carboxylate|CS-W002782|DS-2221|QC-4886|1,3-Benzodioxole-4-carboxylic acid, methyl ester|Methyl benzo[d][13]dioxole-4-carboxylate|methylbenzo[d][1,3]dioxole-4-carboxylate|4CH-009431|M-8336|1,3-benzodioxole-4-carboxylic acid methyl ester|842M169|benzo[1,3]dioxole-4-carboxylic acid methyl ester

CAS: 3407-00-9
Molecular Formula C9H8O4
Molecular Weight 180.04225 g/mol
LogP 1.6
Topological Polar Surface Area 44.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 180.04225
Monoisotopic Mass 180.04225
Heavy Atoms 13
Complexity 204.0

Chemical Identifiers

CAS Number 3407-00-9
SMILES COC(=O)C1=C2C(=CC=C1)OCO2
InChIKey KRPFJCUXHWEVMS-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (2 patents) Heterocyclic Building Blocks (35 patents) Organic Building Blocks (1 patents) Pharmaceutical Intermediates (37 patents)

Product Overview

Methyl benzo[d][1,3]dioxole-4-carboxylate (CAS 3407-00-9), with molecular formula C9H8O4 and molecular weight 180.04225 g/mol. IUPAC: methyl 1,3-benzodioxole-4-carboxylate.

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