Propazine

C₉H₁₆ClN₅CAS 139-40-2229.71 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₆ClN₅
Molar mass: 229.71 g/mol
Exact mass: 229.1094 Da
Density: 1.162 g/mL (at 20 °C)
Melting point: 229.7 °C
pKa: 1.7 (21 °C)
Water solubility: 8.6 mg/L (22 °C)
logP: 1.01Crippen estimate
Polar surface area: 69.2 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Hazards

Warning

H351 Suspected of causing cancerCarcinogenicity
H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
H410 Very toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 613-067-00-1), via PubChem.

Precautionary statements

P203, P273, P280, P318, P391, P405, P501

Identifiers

CAS number

139-40-2

SMILES

CC(C)N=c1nc(Cl)[nH]c(=NC(C)C)[nH]1

InChIKey

WJNRPILHGGKWCK-UHFFFAOYSA-N

InChI

InChI=1S/C9H16ClN5/c1-5(2)11-8-13-7(10)14-9(15-8)12-6(3)4/h5-6H,1-4H3,(H2,11,12,13,14,15)

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

22 names · show all

1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-bis(1-methylethyl)-
s-Triazine, 2-chloro-4,6-bis(isopropylamino)-
1,3,5-Triazine-2,4-diamine, 6-chloro-N,N′-bis(1-methylethyl)-
6-Chloro-N2,N4-bis(1-methylethyl)-1,3,5-triazine-2,4-diamine
G 30028
Geigy 30,028
2,4-Bis(isopropylamino)-6-chloro-s-triazine
2-Chloro-4,6-bis(isopropylamino)-s-triazine
2-Chloro-4,6-bis(isopropylamino)-1,3,5-triazine
Plantulin
Propazin
Propazine (herbicide)
Propasin
Gesamil
2-Chloro-4-isopropylamino-6-isopropylamino-s-triazine
Milogard
s-Bis(isopropylamino)chlorotriazine
Primatol P
Prozinex
NSC 26002
2,4-Bis[(1-methylethyl)amino]-6-chloro-s-triazine
2,4-Bis(isopropylamino)-6-chloro-1,3,5-triazine

Work with Propazine

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Atrazine1912-24-971 % similar Prometryn7287-19-657 % similar Simazine122-34-944 % similar Ametryn834-12-842 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Terbuthylazine5915-41-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook