2-[2,4-Dimethylphenyl]-4,5-dihydro-4,4-dimethyloxazole

HCID 22117273
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Basic information

Standard SMILES
Cc1ccc(C2=NC(C)(C)CO2)c(C)c1
InChIKey
IDEKZNIAXVSSMG-UHFFFAOYSA-N
Molecular formula
C13H17NO
Average molar mass
203.28 g/mol

Names & identifiers

Preferred name
2-[2,4-Dimethylphenyl]-4,5-dihydro-4,4-dimethyloxazole
IUPAC
2-(2,4-dimethylphenyl)-4,4-dimethyl-5H-1,3-oxazole

Names & synonyms

2-[2,4-Dimethylphenyl]-4,5-dihydro-4,4-dimethyloxazole216658-38-7SCHEMBL7490435IDEKZNIAXVSSMG-UHFFFAOYSA-NDB-3380104,5-Dihydro-4,4-dimethyl-2-[2,4-dimethylphenyl]oxazole

Database identifiers

PubChem CID
22117273

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
21.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
15

Related reactions

4 records
New reaction record

Linked notes

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