Chemical Properties of Disulfide, bis[n(benzothiazol-2-yl)-2-aminoethyl] (CAS 98782-06-0)

Disulfide, bis[n(benzothiazol-2-yl)-2-aminoethyl]

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InChI
InChI=1S/C18H18N4S4/c1-3-7-15-13(5-1)21-17(25-15)19-9-11-23-24-12-10-20-18-22-14-6-2-4-8-16(14)26-18/h1-8H,9-12H2,(H,19,21)(H,20,22)
InChI Key
BFRPCSUPHDDASD-UHFFFAOYSA-N
Formula
C18H18N4S4
SMILES
c1ccc2sc(NCCSSCCNc3nc4ccccc4s3)nc2c1
Molecular Weight1
418.62
CAS
98782-06-0
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Physical Properties

Property Value Unit Source
ω 0.7893 Relay (... Calculated Property
ΔfG° 554.57 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas 395.02 kJ/mol Relay (... Calculated Property
ΔvapH° 182.50 kJ/mol Relay (... Calculated Property
IE 8.13 eV Relay (... Calculated Property
log10WS -5.92 Relay (... Calculated Property
logPoct/wat 5.811 Crippen Calculated Property
McVol 291.960 ml/mol McGowan Calculated Property
Pc 2888.76 kPa Relay (... Calculated Property ⚠️
Tboil 785.79 K Relay (... Calculated Property
Tc 1178.27 K Relay (... Calculated Property
Tfus 421.53 K Relay (... Calculated Property
Vc 1.008 m3/kmol Relay (... Calculated Property

Similar Compounds

Acetoacetamide, n-(2-benzothiazolyl)-. Carteolol, PFB-TMS. 3'-acetylmyoscorpine. 2-Hydroxy-2-phenylethylamine, ferrocenylboronate. 5-Hydroxytryptophan, methyl, 2-PFP. 7-diacetyllycopsamine. 3'-acetylechiupinine. Tryptophan-leucine-methionine,N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. 7-acetyl-9-(2-hydroxy-3-methylbutyryl) retronecine. N-Acetylnornarcotine. 5-Hydroxytryptophan, methyl, 3-PFP. Bialophos, N,O,O-tris(tert-butyldimethylsilyl)deriv.. Acetylseneciphylline. L-Alanine, N-[N-[N-[N-(1-oxodecyl)glycyl]-L-tryptophyl]-L-alanyl]-, methyl ester. Spartioidine, 12-acetyl.

Find more compounds similar to Disulfide, bis[n(benzothiazol-2-yl)-2-aminoethyl].

Sources

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