Isopyrine hydrochloride
Properties
- Molecular formula
- C14H20ClN3O
- Molar mass
- 281.78 g/mol
- Exact mass
- 281.1295 Da
- logP
- 2.73Crippen estimate
- Polar surface area
- 39.0 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 3
Hazards
Warning
- H302 Harmful if swallowed97.4% of notifiers
Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P270, P301+P317, P330, P501
Identifiers
CAS number
18342-39-7SMILES
Cc1c(NC(C)C)c(=O)n(-c2ccccc2)n1C.ClInChIKey
WJPVTNJDDFIBKU-UHFFFAOYSA-NInChI
InChI=1S/C14H19N3O.ClH/c1-10(2)15-13-11(3)16(4)17(14(13)18)12-8-6-5-7-9-12;/h5-10,15H,1-4H3;1HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-, hydrochloride (1:1)
- Antipyrine, 4-(isopropylamino)-, monohydrochloride
- 3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-, monohydrochloride
- Ramifenazone hydrochloride
Work with Isopyrine hydrochloride
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
4-Aminoantipyrine hydrochloride22198-72-760 % similar
Propyphenazone479-92-557 % similar
Ampyrone83-07-853 % similar
Diantipyrylmethane1251-85-052 % similar
4-Iodoantipyrine129-81-752 % similar
Aminopyrine58-15-150 % similar
2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-carbaldehyde950-81-250 % similar
4-Acetylaminoantipyrine83-15-845 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.