2-Methyl-5-vinylpyridine
Properties
- Molecular formula
- C8H9N
- Molar mass
- 119.17 g/mol
- Exact mass
- 119.0735 Da
- Density
- 0.978–0.982 g/mL (at 20 °C)
- Melting point
- −12 °C
- Boiling point
- 181 °C
- pKa
- 5.67 (conjugate acid)
- Flash point
- 73.9 °C (open cup)
- logP
- 2.03Crippen estimate
- Polar surface area
- 12.9 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H226 Flammable liquid and vapor12.5% of notifiers
- H302 Harmful if swallowed87.5% of notifiers
- H311 Toxic in contact with skin81.2% of notifiers
- H314 Causes severe skin burns and eye damage25% of notifiers
- H315 Causes skin irritation75% of notifiers
- H317 May cause an allergic skin reaction18.8% of notifiers
- H318 Causes serious eye damage12.5% of notifiers
- H319 Causes serious eye irritation75% of notifiers
- H330 Fatal if inhaled81.2% of notifiers
- H412 Harmful to aquatic life with long lasting effects12.5% of notifiers
Aggregated from 16 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P320, P321, P330, P332+P317, P333+P317, P337+P317, P361+P364, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
140-76-1SMILES
C=Cc1ccc(C)nc1InChIKey
VJOWMORERYNYON-UHFFFAOYSA-NInChI
InChI=1S/C8H9N/c1-3-8-5-4-7(2)9-6-8/h3-6H,1H2,2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Pyridine, 5-ethenyl-2-methyl-
- 2-Picoline, 5-vinyl-
- 5-Ethenyl-2-methylpyridine
- 5-Vinyl-2-picoline
Work with 2-Methyl-5-vinylpyridine
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
6-Methyl-3-pyridinecarboxaldehyde53014-84-959 % similar
2,5-Dimethylpyridine589-93-546 % similar
4-Vinyltoluene622-97-946 % similar
5-Hydroxy-2-methylpyridine1121-78-443 % similar
5-Fluoro-2-methylpyridine31181-53-043 % similar
5-Bromo-2-methylpyridine3430-13-543 % similar
5-Amino-2-methylpyridine3430-14-643 % similar
5-Chloro-2-methylpyridine72093-07-343 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds