chempirical

3,5-Di-tert-butyl-4-hydroxybenzaldehyde

C15H22O2CAS 1620-98-0234.34 g/mol

Open in Covalent MOL file
OHO
AldehydePhenol

Properties

Molecular formula
C15H22O2
Molar mass
234.34 g/mol
Exact mass
234.1620 Da
Melting point
189 °C
logP
3.80Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
1620-98-0
SMILES
CC(C)(C)c1cc(C=O)cc(C(C)(C)C)c1O
InChIKey
DOZRDZLFLOODMB-UHFFFAOYSA-N
InChI
InChI=1S/C15H22O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-9,17H,1-6H3

Weigh it out

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

Names and synonyms

8 names
  • Benzaldehyde, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-
  • Benzaldehyde, 3,5-di-tert-butyl-4-hydroxy-
  • 3,5-Bis(1,1-dimethylethyl)-4-hydroxybenzaldehyde
  • 2,6-Di-tert-Butyl-4-formylphenol
  • 4-Hydroxy-3,5-di-tert-butylbenzaldehyde
  • 4-Formyl-2,6-di-tert-butylphenol
  • NSC 14450
  • 3,5-Ditert-butyl-4-hydroxybenzaldehyde

Work with 3,5-Di-tert-butyl-4-hydroxybenzaldehyde

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

2,4,6-Tri-tert-butylphenol732-26-355 % similar Butylated hydroxytoluene128-37-053 % similar 4-Bromo-2,6-di-tert-butylphenol1139-52-252 % similar 4,4′-Methylenebis[2,6-di-tert-butylphenol]118-82-152 % similar 3,5-Dimethyl-4-hydroxybenzaldehyde2233-18-352 % similar 2,6-Bis(1,1-dimethylethyl)-4-mercaptophenol950-59-452 % similar Sf-684710537-47-051 % similar 3,4,5-Trihydroxybenzaldehyde13677-79-750 % similar

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

Same formula

3,5-Bis(1,1-dimethylethyl)benzoic acid16225-26-6 2-Methyl-2-adamantyl methacrylate177080-67-0 Curcumenol19431-84-6 4-(Octyloxy)benzaldehyde24083-13-4 Valerenic acid3569-10-6 4-Octylbenzoic acid3575-31-3 3,5-Di-tert-butylsalicylaldehyde37942-07-7 4-Methylphenyl octanoate59558-23-5

Elsewhere

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