2-(2-Methoxyphenyl)-4,4-dimethyl-2-oxazoline

C12H15NO2CAS 57598-33-1205.26 g/mol

Open in Covalent MOL file
ONO
Ether

Properties

Molecular formula
C12H15NO2
Molar mass
205.26 g/mol
Exact mass
205.1103 Da
logP
2.25Crippen estimate
Polar surface area
30.8 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
57598-33-1
SMILES
CC1(COC(=N1)C2=CC=CC=C2OC)C
InChIKey
ZGDUNGBWVZKWGE-UHFFFAOYSA-N
InChI
InChI=1S/C12H15NO2/c1-12(2)8-15-11(13-12)9-6-4-5-7-10(9)14-3/h4-7H,8H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names
  • 4,4-Dimethyl-2-(2-methoxyphenyl)oxazoline

Work with 2-(2-Methoxyphenyl)-4,4-dimethyl-2-oxazoline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4,5-Dihydro-4,4-dimethyl-2-(3-pyridyl)oxazole68981-86-247 % similar Ethyl 2-methoxybenzoate7335-26-443 % similar 2'-Methoxyacetophenone579-74-841 % similar 2-Bromo-1-(2-methoxyphenyl)ethanone31949-21-041 % similar 2-Methoxybenzohydrazide7466-54-841 % similar 2-Methoxybenzoyl chloride21615-34-940 % similar 2-Methoxybenzamide2439-77-240 % similar 2-Methoxybenzoic acid529-75-940 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-Phenyl-isobutyloylacetamide124401-38-3 Methyl 4-pyrrolidin-1-ylbenzoate129414-26-2 Methyl 1-benzylazetidine-2-carboxylate18085-37-5 4-Piperidin-1-yl-benzoic acid22090-24-0 3,4-Diethoxybenzeneacetonitrile27472-21-5 N-Benzyl-L-proline31795-93-4 4-Phenyl-4-piperidinecarboxylic acid3627-45-0 4-Morpholinoacetophenone39910-98-0

Elsewhere

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