Chemical Properties of Prometryn (CAS 7287-19-6)

Prometryn

InChI
InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)
InChI Key
AAEVYOVXGOFMJO-UHFFFAOYSA-N
Formula
C10H19N5S
SMILES
CSc1nc(=NC(C)C)[nH]c(=NC(C)C)[nH]1
Molecular Weight1
241.36
CAS
7287-19-6
Other Names
  • 1,3,5-Triazine-2,4-diamine, N,N'-bis(1-methylethyl)-6-(methylthio)-
  • 2,4-Bis(isopropylamino)-6-(methylmercapto)-s-triazine
  • 2,4-Bis(isopropylamino)-6-(methylthio)-1,3,5-triazine
  • 2,4-Bis(isopropylamino)-6-(methylthio)-s-triazine
  • 2-(Methylmercapto)-4,6-bis(isopropylamino)-s-triazine
  • 2-(Methylthio)-4,6-bis(isopropylamino)-s-triazine
  • A 1114
  • Caparol
  • Caparol 80W
  • G 34161
  • Gesagard
  • Gesagard 50
  • Gesagarde 50 Wp
  • Mercasin
  • Mercazin
  • Merkazin
  • N,N'-Bis(1-methylethyl)-6-methylthio-1,3,5-triazine-2,4-diamine
  • NSC 163049
  • Polisin
  • Primatol Q
  • Promepin
  • Promethryn
  • Promethryne
  • Prometrex
  • Prometrin
  • Prometryne
  • S-Triazine, 2,4-bis(isopropylamino)-6-methylmercapto-
  • Selectin
  • Selectin 50
  • Selektin
  • Sesagard
  • Uvon
  • s-Triazine, 2,4-bis(isopropylamino)-6-(methylthio)-
  • s-Triazine, 4,6-bis(isopropylamino)-2-(methylmercapto)-
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Physical Properties

Property Value Unit Source
ω 0.6031 Relay (1.0) Calculated Property
ΔfG° 380.68 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -1.56 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 117.29 kJ/mol Relay (1.0) Calculated Property
IE 7.78 eV Relay (1.0) Calculated Property
log10WS [-4.10; -4.10]   Show Hide
log10WS -4.10 Aq. Solubility Prediction
log10WS -4.10 Estimated Solubility
logPoct/wat 0.114 Crippen Calculated Property
McVol 194.250 ml/mol McGowan Calculated Property
Pc 2408.71 kPa Relay (1.0-beta) Calculated Property
Inp [1870.00; 1919.00]   Show Hide
Inp 1870.00 NIST
Inp 1916.00 NIST
Inp 1883.00 NIST
Inp 1919.00 NIST
I 2758.00 NIST
Tboil 571.36 K Relay (1.0) Calculated Property
Tc 838.34 K Relay (1.0) Calculated Property
Tfus 413.33 K Relay (1.0) Calculated Property
Vc 0.696 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.62] kPa [481.69; 603.05] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A2.52502e+01
Coefficient B-1.20241e+04
Temperature range, min.481.69
Temperature range, max.603.05
Pvap 1.33 kPa 481.69 Calculated Property
Pvap 2.63 kPa 495.17 Calculated Property
Pvap 5.01 kPa 508.66 Calculated Property
Pvap 9.22 kPa 522.14 Calculated Property
Pvap 16.47 kPa 535.63 Calculated Property
Pvap 28.58 kPa 549.11 Calculated Property
Pvap 48.31 kPa 562.60 Calculated Property
Pvap 79.67 kPa 576.08 Calculated Property
Pvap 128.42 kPa 589.57 Calculated Property
Pvap 202.62 kPa 603.05 Calculated Property

Similar Compounds

Dipropetryn. Cyromazine. 6-Chloro-N,N'-(1-methylpropyl)-[1,3,5]triazine-2,4-diamine. 6-Chloro-N,N'-(cyclobutyl)-[1,3,5]triazine-2,4-diamine. 6-Chloro-N,N'-(cyclohexyl)-[1,3,5]triazine-2,4-diamine. s-Triazine, 2-chloro, 4-(1-methylethyl)amino-6-(1,1-dimethylethyl)amino. Spiperone. L-HYDROXYPROLINE,N,O,O-TMS. Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-6-(hydroxymethyl)-1,6-dimethyl-, (-)-. deoxyinosine, TMS. 6-Dehydroestradiol, TMS. Estra-1,3,5(10),6-tetraene-3,17-diol, (17«beta»)-. Estrone, TMS. 2'-Deoxyadenosine, 3',5'-bis(O-TMTBSi). 2'-Deoxyadenosine, 3',5'-bis-O-cyclotetramethylene-isopropylsilyl.

Find more compounds similar to Prometryn.

Sources

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