2,8-Dimethylquinoline
Properties
- Molecular formula
- C11H11N
- Molar mass
- 157.22 g/mol
- Exact mass
- 157.0891 Da
- Density
- 1.036 g/mL (at 20 °C)
- Melting point
- 27 °C
- Boiling point
- 255.3 °C
- logP
- 2.85Crippen estimate
- Polar surface area
- 12.9 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowed97.5% of notifiers
- H315 Causes skin irritation100% of notifiers
- H318 Causes serious eye damage97.5% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1463-17-8SMILES
Cc1ccc2cccc(C)c2n1InChIKey
BELFSAVWJLQIBB-UHFFFAOYSA-NInChI
InChI=1S/C11H11N/c1-8-4-3-5-10-7-6-9(2)12-11(8)10/h3-7H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Quinoline, 2,8-dimethyl-
- o-Toluquinaldine
- 8-Methylquinaldine
- NSC 62133
Work with 2,8-Dimethylquinoline
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
Neocuproine484-11-764 % similar
8-Aminoquinaldine18978-78-463 % similar
8-Chloro-2-methylquinoline3033-82-763 % similar
8-Bromo-2-methyl-quinoline61047-43-663 % similar
2-Methyl-8-hydroxyquinoline826-81-361 % similar
Neocuproine hemihydrate34302-69-757 % similar
8-Methylquinoline611-32-553 % similar
2-Methyl-8-nitroquinoline881-07-251 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.