Chemical Properties of 2,4-Pyrimidinediamine, 6-chloro-5-nitro- (CAS 6036-64-2)

2,4-Pyrimidinediamine, 6-chloro-5-nitro-

InChI
InChI=1S/C4H4ClN5O2/c5-2-1(10(11)12)3(6)9-4(7)8-2/h(H4,6,7,8,9)
InChI Key
PQRPNYCCQLFXNK-UHFFFAOYSA-N
Formula
C4H4ClN5O2
SMILES
Nc1nc(N)c([N+](=O)[O-])c(Cl)n1
Molecular Weight1
189.56
CAS
6036-64-2
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Physical Properties

Property Value Unit Source
ω 0.6966 Relay (1.0) Calculated Property
ΔfG° 340.23 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 81.37 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 87.70 kJ/mol Relay (1.0) Calculated Property
IE 9.07 eV Relay (1.0) Calculated Property
log10WS -3.76 Relay (1.0) Calculated Property
logPoct/wat 0.203 Crippen Calculated Property
McVol 113.040 ml/mol McGowan Calculated Property
Pc 4476.92 kPa Relay (1.0-beta) Calculated Property
Tboil 560.14 K Relay (1.0) Calculated Property
Tc 921.10 K Relay (1.0) Calculated Property
Tfus 484.61 K Relay (1.0) Calculated Property
Vc 0.395 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Pyrimidine, 4-amino-2,6-dichloro-5-nitro-. Pyrimidine, 4-amino-6-chloro-5-nitro-. Formamide, n-(2,4-diamino-6-chloro-5-pyrimidinyl)-. Pyrimidine, 4-chloro-6-hydrazino-5-nitro-. Pyrimidine, 2,4-diamino-6-chloro-5-(p-chlorophenylazo)-. Pyrimidine, 6-amino-2,4-dichloro-5-nitro, TMS. Ethanol, 2-[(6-amino-2-chloro-5-nitro-4-pyrimidinyl)amino]-. Pyrimidine, 2-amino-4-chloro-5-(p-chlorophenylazo)-6-ethylamino-. 4(3H)-pyrimidinone, 6-amino-2-chloro-5-nitro-. 4-Chloro-2,6-diaminopyrimidine. Pyrimidine, 2-amino-4-(butylamino)-6-chloro-5-[(p-chlorophenyl)azo]-. Pyrimidine, 4-amino-6-hydrazino-5-nitro-. Pyridine, 2,6-diamino-4-[(diphenylmethyl)amino]-3-nitro-. Ethanol, 2-[(6-amino-5-nitro-4-pyrimidinyl)thio]-. Pyrimidine, 4,6-diamino-2-methyl-5-nitro-.

Find more compounds similar to 2,4-Pyrimidinediamine, 6-chloro-5-nitro-.

Sources

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