2,6-Diisopropylnaphthalene

C₁₆H₂₀CAS 24157-81-1212.34 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₆H₂₀
Molar mass: 212.34 g/mol
Exact mass: 212.1565 Da
Melting point: 66.8 °C
logP: 5.09Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed84.8% of notifiers
H400 Very toxic to aquatic life84.8% of notifiers
H410 Very toxic to aquatic life with long lasting effects93.5% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P391, P501

Identifiers

CAS number

24157-81-1

SMILES

CC(C)c1ccc2cc(C(C)C)ccc2c1

InChIKey

GWLLTEXUIOFAFE-UHFFFAOYSA-N

InChI

InChI=1S/C16H20/c1-11(2)13-5-7-16-10-14(12(3)4)6-8-15(16)9-13/h5-12H,1-4H3

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Names and synonyms

5 names

Naphthalene, 2,6-bis(1-methylethyl)-
Naphthalene, 2,6-diisopropyl-
2,6-Bis(1-methylethyl)naphthalene
NSC 166467
2,6-Di(propan-2-yl)naphthalene

Work with 2,6-Diisopropylnaphthalene

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-Isopropylnaphthalene2027-17-081 % similar 6-Isopropylisoquinoline790304-84-665 % similar 1,4-Diisopropylbenzene100-18-561 % similar 1,3-Diisopropylbenzene99-62-757 % similar 1,3,5-Triisopropylbenzene717-74-853 % similar 4,4'-Diisopropylbiphenyl18970-30-452 % similar 6-Isopropylquinoline135-79-552 % similar Retene483-65-852 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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