2,3-Dihydro-2,2-dimethylbenzofuran

HCID 80640

Notes Reactions

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Basic information

CAS: 6337-33-3
Standard SMILES: CC1(C)Cc2ccccc2O1
InChIKey: UJMGZPCKYHBCKU-UHFFFAOYSA-N
Molecular formula: C10H12O
Average molar mass: 148.2 g/mol
Monoisotopic mass: 148.088815

Overview

2,2-dimethyl-2,3-dihydrobenzofuran is a member of 1-benzofurans.

Names & identifiers

Preferred name: 2,3-Dihydro-2,2-dimethylbenzofuran
IUPAC: 2,2-dimethyl-3H-1-benzofuran
English name: 2,3-dihydro-2,2-dimethylbenzofuran
Molecular formula: C10H12O
Molecular weight: 148.2

Names & synonyms

6337-33-32,3-Dihydro-2,2-dimethylbenzofuran2,2-dimethyl-2,3-dihydrobenzofuranBenzofuran, 2,3-dihydro-2,2-dimethyl-BL24599Q2HEINECS 228-724-4NSC 38016NSC-38016CHEBI:38475DTXSID10212773RefChem:81676DTXCID40135264

Show more names

228-724-42,2-dimethyl-2,3-dihydro-1-benzofuran2,2-dimethyl-3H-1-benzofuran2,2-dimethyl-3H-benzofuran2,2-Dimethyl-2,3-dihydro-benzofuranMFCD120280542,2-Dimethyl-2,3-dihydrobenzo[b]furanNSC38016

Database identifiers

CAS: 6337-33-3
PubChem CID: 80640
DTXSID: DTXSID10212773
ChEBI: CHEBI:38475
UNII: BL24599Q2H
EC Number: 228-724-4
Nikkaji: J206.937G

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 11
Formal charge: 0
Complexity: 151

Physicochemical properties

FDA UNII: 24599 Q2H · BL24599Q2H
HazardClass: IRRITANT

Safety & regulation

Safety data

hazard_class: IRRITANT

Chemistry & industry

Applications

Uses2,2-dimethyl-2,3-dihydro-1-benzofuran (cas# 6337-33-3) is used as a reagent in the preparation of heteroaryl compounds as kynurenine-3-monooxygenase inhibitors for treatment of neurodegenerative disorders.