Chemical Properties of Semicarbazide, 4-methyl-1-(2-pyrimidinyl)- (CAS 116659-63-3)

Semicarbazide, 4-methyl-1-(2-pyrimidinyl)-

InChI
InChI=1S/C6H9N5O/c1-7-6(12)11-10-5-8-3-2-4-9-5/h2-4H,1H3,(H2,7,11,12)(H,8,9,10)
InChI Key
WMTYQZVHQNYTHP-UHFFFAOYSA-N
Formula
C6H9N5O
SMILES
CNC(=O)NNc1ncccn1
Molecular Weight1
167.17
CAS
116659-63-3
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Physical Properties

Property Value Unit Source
ω 0.6208 Relay (1.0) Calculated Property
ΔfG° 268.72 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 34.24 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 107.64 kJ/mol Relay (1.0) Calculated Property
IE 8.54 eV Relay (1.0) Calculated Property
log10WS -1.38 Relay (1.0) Calculated Property
logPoct/wat -0.268 Crippen Calculated Property
McVol 123.110 ml/mol McGowan Calculated Property
Pc 5865.68 kPa Relay (1.0-beta) Calculated Property
Tboil 568.90 K Relay (1.0) Calculated Property
Tc 871.80 K Relay (1.0) Calculated Property
Tfus 466.80 K Relay (1.0) Calculated Property
Vc 0.434 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

9H-purine, 6-[4-methyl-3-thiosemicarbazido]-. 5-Hydroxyindoleacetic acid, ethoxycarbonylated, TBDMS. 1H-naphth[1,2-d]imidazole, 1-(p-bromoanilino)-2-(p-nitrophenyl)-. nevirapine. carpipramine. RTI 15. 5-(4-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine, N,N'-bis(trifluoroacetyl)-. 1,2,3,4,6,7,8,9,10,11-Decahydro-5,11a-diaza-cycloocta[b]naphthalen-12-one. 2,3,4,5,7,8,9,10,11,12-Decahydro-1H-5a,13-diaza-cyclohepta[4,5]benzo[1,2]cycloocten-6-one. 3H-Pyrimidin-4-one, 2,3-pentamethyleno-5,6-tetramethyleno. 3H-Pyrimidin-4-one, 2,3:5,6-bis-hexamethyleno. Adenosine, 2'-deoxy-N-(trifluoroacetyl)-, 3',5'-bis(trifluoroacetate). Idoxuridine. Calacorene oxide. Uridine, 5,6-dihydro-.

Find more compounds similar to Semicarbazide, 4-methyl-1-(2-pyrimidinyl)-.

Sources

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