4-[1-(4,5-Dihydro-4,4-dimethyl-2-oxazolyl)-1-methylethyl]benzeneethanol

C16H23NO2CAS 361382-26-5261.36 g/mol

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OOHN
Alcohol

Properties

Molecular formula
C16H23NO2
Molar mass
261.36 g/mol
Exact mass
261.1729 Da
logP
2.71Crippen estimate
Polar surface area
41.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
361382-26-5
SMILES
CC1(C)COC(C(C)(C)c2ccc(CCO)cc2)=N1
InChIKey
XJZPZWCCWIEQRR-UHFFFAOYSA-N
InChI
InChI=1S/C16H23NO2/c1-15(2)11-19-14(17-15)16(3,4)13-7-5-12(6-8-13)9-10-18/h5-8,18H,9-11H2,1-4H3

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Names and synonyms

2 names
  • Benzeneethanol, 4-[1-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)-1-methylethyl]-
  • 4-(1-(4,5-Dihydro-4,4-dimethyl-2-oxazolyl)-1-methylethyl)benzeneethanol

Work with 4-[1-(4,5-Dihydro-4,4-dimethyl-2-oxazolyl)-1-methylethyl]benzeneethanol

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

2-[4-[1-(4,4-Dimethyl-5H-oxazol-2-yl)-1-methylethyl]phenyl]ethyl 4-methylbenzenesulfonate202189-76-255 % similar 4-(2-Hydroxyethyl)-α,α-dimethylbenzeneacetic acid552301-45-850 % similar 4-(1,1-Dimethylethyl)benzeneethanol5406-86-045 % similar 2-(4-Methoxyphenyl)ethanol702-23-835 % similar 4-Methylbenzeneethanol699-02-534 % similar 2,4,4-Trimethyl-2-oxazoline1772-43-633 % similar 2-(2-Methoxyphenyl)-4,4-dimethyl-2-oxazoline57598-33-133 % similar 4,5-Dihydro-4,4-dimethyl-2-(3-pyridyl)oxazole68981-86-233 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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