2,6-Di-tert-butylpyridine

C₁₃H₂₁NCAS 585-48-8191.32 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₂₁N
Molar mass: 191.32 g/mol
Exact mass: 191.1674 Da
Melting point: 2.2 °C
Boiling point: 100–101 °C
logP: 3.68Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

585-48-8

SMILES

CC(C)(C)c1cccc(C(C)(C)C)n1

InChIKey

UWKQJZCTQGMHKD-UHFFFAOYSA-N

InChI

InChI=1S/C13H21N/c1-12(2,3)10-8-7-9-11(14-10)13(4,5)6/h7-9H,1-6H3

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

Names and synonyms

5 names

Pyridine, 2,6-bis(1,1-dimethylethyl)-
Pyridine, 2,6-di-tert-butyl-
2,6-Bis(1,1-dimethylethyl)pyridine
NSC 175805
2,6-Ditert-butylpyridine

Work with 2,6-Di-tert-butylpyridine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4,6-Tri-tert-butylpyrimidine67490-21-546 % similar 1,3-Di-tert-butylbenzene1014-60-443 % similar tert-Butylbenzene98-06-639 % similar 2,6-Di-tert-butylphenol128-39-238 % similar 1,4-Di-tert-butylbenzene1012-72-238 % similar tert-Butylpyrazine32741-11-037 % similar 4-tert-Butylpyridine3978-81-236 % similar Nitrapyrin1929-82-436 % similar

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

Same formula

N-(1-Ethylpropyl)-3,4-dimethylbenzenamine56038-89-2

Elsewhere

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