2,6-Dimethylisonicotinic acid
Properties
- Molecular formula
- C8H9NO2
- Molar mass
- 151.16 g/mol
- Exact mass
- 151.0633 Da
- logP
- 1.40Crippen estimate
- Polar surface area
- 50.2 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed50% of notifiers
- H312 Harmful in contact with skin50% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled50% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 2 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+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
54221-93-1SMILES
CC1=CC(=CC(=N1)C)C(=O)OInChIKey
JRJLLMLYUFAZOM-UHFFFAOYSA-NInChI
InChI=1S/C8H9NO2/c1-5-3-7(8(10)11)4-6(2)9-5/h3-4H,1-2H3,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 2,6-Dimethylpyridine-4-carboxylic acid
Work with 2,6-Dimethylisonicotinic acid
Similar compounds
2-Chloro-6-methylpyridine-4-carboxylic acid25462-85-573 % similar
2-Methylpyridine-4-carboxylic acid4021-11-861 % similar
Trimesic acid554-95-058 % similar
3,5-Dimethylbenzoic acid499-06-957 % similar
Uvitic acid499-49-057 % similar
Citrazinic acid99-11-655 % similar
2,6-Dibromopyridine-4-carboxylic acid2016-99-153 % similar
2,6-Dichloroisonicotinic acid5398-44-753 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.