Chemical Properties of Pyrimidine, 4-amino-6-chloro-5-nitro- (CAS 4316-94-3)

Pyrimidine, 4-amino-6-chloro-5-nitro-

InChI
InChI=1S/C4H3ClN4O2/c5-3-2(9(10)11)4(6)8-1-7-3/h1H,(H2,6,7,8)
InChI Key
BWLOHIMQWHFSQF-UHFFFAOYSA-N
Formula
C4H3ClN4O2
SMILES
Nc1ncnc(Cl)c1[N+](=O)[O-]
Molecular Weight1
174.54
CAS
4316-94-3
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Physical Properties

Property Value Unit Source
ω 0.5894 Relay (1.0) Calculated Property
ΔfG° 296.46 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 105.52 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 66.72 kJ/mol Relay (1.0) Calculated Property
IE 9.52 eV Relay (1.0) Calculated Property
log10WS -2.98 Relay (1.0) Calculated Property
logPoct/wat 0.620 Crippen Calculated Property
McVol 103.060 ml/mol McGowan Calculated Property
Pc 4812.62 kPa Relay (1.0-beta) Calculated Property
Tboil 544.85 K Relay (1.0) Calculated Property
Tc 873.63 K Relay (1.0) Calculated Property
Tfus 445.39 K Relay (1.0) Calculated Property
Vc 0.359 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Pyrimidine, 4-amino-2,6-dichloro-5-nitro-. Pyrimidine, 4-chloro-6-hydrazino-5-nitro-. 2,4-Pyrimidinediamine, 6-chloro-5-nitro-. Pyrimidine, 4-amino-6-hydrazino-5-nitro-. Formamide, n-(4-amino-6-chloro-5-pyrimidinyl)-. Pyrimidine, 6-amino-2,4-dichloro-5-nitro, TMS. Pyrimidine, 5-amino-4-chloro-6-hydrazino-. Pyrimidine, 5-amino-6-chloro-4-(methylamino)-. 5-Pyrimidinamine, 4-chloro-6-formylhydrazino-. Ethanol, 2-[(6-amino-5-nitro-4-pyrimidinyl)thio]-. Acetic acid, 5-amino-6-chloro-4-pyrimidinyl hydrazide. 5-Amino-6-chloro-4-ethylaminopyrimidine. Pyrimidine, 4,6-diamino-2-methyl-5-nitro-. 4-Pyrimidinol, 6-hydrazino-5-nitro- (keto form). 4(3H)-pyrimidinone, 6-amino-2-chloro-5-nitro-.

Find more compounds similar to Pyrimidine, 4-amino-6-chloro-5-nitro-.

Sources

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