Chemical Properties of 1H-1,2,3-triazole-4-carboxamide, 5-[3-(p-bromophenyl)-1-triazeno]- (CAS 7229-15-4)

1H-1,2,3-triazole-4-carboxamide, 5-[3-(p-bromophenyl)-1-triazeno]-

InChI
InChI=1S/C9H8BrN7O/c10-5-1-3-6(4-2-5)12-16-14-9-7(8(11)18)13-17-15-9/h1-4H,(H2,11,18)(H2,12,13,14,15,17)
InChI Key
MJIHKQOPKHLWJE-UHFFFAOYSA-N
Formula
C9H8BrN7O
SMILES
NC(=O)c1nn[nH]c1N=NNc1ccc(Br)cc1
Molecular Weight1
310.11
CAS
7229-15-4
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Physical Properties

Property Value Unit Source
ω 0.9008 Relay (1.0) Calculated Property
Δf 479.11 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas 388.32 kJ/mol Relay (1.0) Calculated Property
Δvap 117.19 kJ/mol Relay (1.0) Calculated Property
IE 8.28 eV Relay (1.0) Calculated Property
log10WS -4.35 Relay (1.0) Calculated Property
logPoct/wat 1.295 Crippen Calculated Property
McVol 179.080 ml/mol McGowan Calculated Property
Pc 5767.94 kPa Relay (1.0-beta) Calculated Property
Tboil 664.47 K Relay (1.0) Calculated Property
Tc 1083.28 K Relay (1.0) Calculated Property
Tfus 552.90 K Relay (1.0) Calculated Property
Vc 0.644 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Triazole-4-carboxamide, (1h)-1,2,3-, 5-[(n-methyl-n-phenyl)-1-triazeno]-. 6-Dehydroestrone (enol), TMS. 5-Hydroxytryptophan, methyl, 2-PFP. claritine. Azatadine M (nor, OH), acetylated. propyl-cannabinolic acid, n-butyl-boronate. Azatadine M (OH), acetylated. 11B-Hydroxyoestrone (enol), TMS. Estrone, VDMS. Poligodial + p-Tyr (ethyl ester) adduct (S). 5-Hydroxytryptophan, methyl, 3-PFP. Morazone. Poligodial + o-Tyr (ethyl ester) adduct (R,S). Poligodial + p-Tyr (ethyl ester) adduct (S), acetylated, # 2. Metergoline.

Find more compounds similar to 1H-1,2,3-triazole-4-carboxamide, 5-[3-(p-bromophenyl)-1-triazeno]-.

Sources

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