Chemical Properties of 2-Propenethioamide, 2-cyano-3-(4-nitrophenyl)-, (E)- (CAS 68029-55-0)

2-Propenethioamide, 2-cyano-3-(4-nitrophenyl)-, (E)-

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InChI
InChI=1S/C10H7N3O2S/c11-6-8(10(12)16)5-7-1-3-9(4-2-7)13(14)15/h1-5H,(H2,12,16)/b8-5+
InChI Key
ZJUPLUDEWMWRRF-VMPITWQZSA-N
Formula
C10H7N3O2S
SMILES
N#CC(=Cc1ccc([N+](=O)[O-])cc1)C(N)=S
Molecular Weight1
233.25
CAS
68029-55-0
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Physical Properties

Property Value Unit Source
Δf 560.01 kJ/mol Joback Calculated Property
Δfgas 417.17 kJ/mol Joback Calculated Property
Δfus 36.87 kJ/mol Joback Calculated Property
Δvap 85.27 kJ/mol Joback Calculated Property
log10WS -3.94 Crippen Calculated Property
logPoct/wat 1.788 Crippen Calculated Property
McVol 164.530 ml/mol McGowan Calculated Property
Pc 3589.94 kPa Joback Calculated Property
Tboil 860.39 K Joback Calculated Property
Tc 1144.70 K Joback Calculated Property
Tfus 548.49 K Joback Calculated Property
Vc 0.641 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [413.25; 460.17] J/mol×K [860.39; 1144.70] Show Hide
Cp,gas 413.25 J/mol×K 860.39 Joback Calculated Property
Cp,gas 421.43 J/mol×K 907.78 Joback Calculated Property
Cp,gas 429.22 J/mol×K 955.16 Joback Calculated Property
Cp,gas 436.81 J/mol×K 1002.55 Joback Calculated Property
Cp,gas 444.37 J/mol×K 1049.93 Joback Calculated Property
Cp,gas 452.10 J/mol×K 1097.32 Joback Calculated Property
Cp,gas 460.17 J/mol×K 1144.70 Joback Calculated Property

Similar Compounds

Cinnamamide, «alpha»-cyano-m-nitrothio- (7CI). 2-Propenethioamide, 3-(4-bromophenyl)-2-cyano-, (E)-. 2-Propenethioamide, 3-(4-chlorophenyl)-2-cyano-, (E)-. 2-Propenethioamide, 2-cyano-3-(4-fluorophenyl)-, (E)-. Nitrobenzene, 4-(2-cyano-2-phenylethenyl). 4-Nitrocinnamaldehyde. Nitrobenzene, 3-(2,2-dicyanoethenyl). p-Nitrobenzylidene-p-chlorophenylacetonitrile. P-nitro cinnamic acid, methyl ester. 4-Nitrocinnamic acid. p-Nitrobenzylidene-p-isopropylphenylacetonitrile. p-Nitrobenzylidene-2-methylphenylacetonitrile. 2-Propenoic acid, 3-(4-nitrophenyl)-, ethyl ester. p-Nitrobenzylidene-2,5-dimethylphenylacetonitrile. (E)-4-Nitrostilbene.

Find more compounds similar to 2-Propenethioamide, 2-cyano-3-(4-nitrophenyl)-, (E)-.

Sources

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