Irgarol
Properties
- Molecular formula
- C11H19N5S
- Molar mass
- 253.37 g/mol
- Exact mass
- 253.1361 Da
- Melting point
- 128–133 °C
- Water solubility
- 7 mg/L
- logP
- 1.80Crippen estimate
- Polar surface area
- 66.0 Ų
- H-bond donors / acceptors
- 2 / 5
- Rotatable bonds
- 3
Hazards
Warning
- H317 May cause an allergic skin reaction96.8% of notifiers
- H400 Very toxic to aquatic life84% of notifiers
- H410 Very toxic to aquatic life with long lasting effects75.9% of notifiers
Aggregated from 187 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, P501
Identifiers
CAS number
28159-98-0SMILES
CSc1nc(=NC2CC2)nc(NC(C)(C)C)[nH]1InChIKey
HDHLIWCXDDZUFH-UHFFFAOYSA-NInChI
InChI=1S/C11H19N5S/c1-11(2,3)16-9-13-8(12-7-5-6-7)14-10(15-9)17-4/h7H,5-6H2,1-4H3,(H2,12,13,14,15,16)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
21 names · show all
- 1,3,5-Triazine-2,4-diamine, N2-cyclopropyl-N4-(1,1-dimethylethyl)-6-(methylthio)-
- s-Triazine, 2-(tert-butylamino)-4-(cyclopropylamino)-6-(methylthio)-
- 1,3,5-Triazine-2,4-diamine, N-cyclopropyl-N′-(1,1-dimethylethyl)-6-(methylthio)-
- N2-Cyclopropyl-N4-(1,1-dimethylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine
- 2-(Methylthio)-4-(tert-butylamino)-6-(cyclopropylamino)-s-triazine
- 2-(tert-Butylamino)-4-(cyclopropylamino)-6-(methylthio)-1,3,5-triazine
- Irgarol 1051
- Irgarol 1071
- Irgaguard A 2000
- Cybutrin
- Nuocide 1051
- N-Cyclopropyl-N′-(1,1-dimethylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine
- Microban additive IA 1
- Cybutryne
- Irgaguard D 1071
- 2-Methylthio-4-tert-butylamino-6-cyclopropylamino-[1,3,5]triazine
- 2-Methylthio-4-t-butylamino-6-cyclopropylamino-s-triazine
- DP 2159
- SanAlga 1907
- 2-(tert-Butylamino)-4-(cyclopropylamino)-6-(methylthio)-s-triazine
- 2-N-tert-Butyl-4-N-cyclopropyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine
Work with Irgarol
Similar compounds
Terbutryn886-50-066 % similar
Terbuthylazine5915-41-334 % similar
Prometryn7287-19-632 % similar
Ametryn834-12-831 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.