4-[[2-(1-Methylethoxy)ethoxy]methyl]phenol

C₁₂H₁₈O₃CAS 177034-57-0210.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₈O₃
Molar mass: 210.27 g/mol
Exact mass: 210.1256 Da
logP: 2.33Crippen estimate
Polar surface area: 38.7 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 6

Identifiers

CAS number

177034-57-0

SMILES

CC(C)OCCOCc1ccc(O)cc1

InChIKey

ISQLWWCGQXEAJG-UHFFFAOYSA-N

InChI

InChI=1S/C12H18O3/c1-10(2)15-8-7-14-9-11-3-5-12(13)6-4-11/h3-6,10,13H,7-9H2,1-2H3

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Names and synonyms

2 names

Phenol, 4-[[2-(1-methylethoxy)ethoxy]methyl]-
4-[(2-Isopropoxyethoxy)methyl]phenol

Work with 4-[[2-(1-Methylethoxy)ethoxy]methyl]phenol

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-[[2-(1-Methylethoxy)ethoxy]methyl]phenoxy]methyl]oxirane66722-57-457 % similar Bisoprolol66722-44-950 % similar 4-(2-Methoxyethyl)phenol56718-71-946 % similar Bisoprolol fumarate104344-23-241 % similar Benzyl isopentyl ether122-73-638 % similar 4-Ethylphenol123-07-938 % similar Bisphenol F620-92-838 % similar 4-Propylphenol645-56-737 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Octenylsuccinic anhydride42482-06-4 Vanillyl butyl ether82654-98-6

Elsewhere

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