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6-Methoxy-2-(1-methylethyl)benzofuran

HCID 10797752
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc2cc(C(C)C)oc2c1
InChIKey
YEZWECDZSNKRBQ-UHFFFAOYSA-N
Molecular formula
C12H14O2
Average molar mass
190.24 g/mol
Monoisotopic mass
190.09937969

Names & identifiers

Preferred name
6-Methoxy-2-(1-methylethyl)benzofuran
IUPAC
6-methoxy-2-propan-2-yl-1-benzofuran

Names & synonyms

SCHEMBL5240659YEZWECDZSNKRBQ-UHFFFAOYSA-N6-methoxy-2-(1-methylethyl)benzofuranInChI=1/C12H14O2/c1-8(2)11-6-9-4-5-10(13-3)7-12(9)14-11/h4-8H,1-3H

Database identifiers

PubChem CID
10797752
Nikkaji
J1.163.558J

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
22.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
191

Related reactions

5 records
New reaction record
HRID 945725 reaction equation
HRID 945725As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 985203 reaction equation
HRID 985203As productuspto-grants-2005_03
HRID 985204 reaction equation
HRID 985204As reactantuspto-grants-2005_03
HRID 1825079 reaction equation
HRID 1825079As productuspto-grants-2006_05
HRID 1825080 reaction equation
HRID 1825080As reactantuspto-grants-2006_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes