Chemical Properties of Rhodanine, 5-benzylidene-3-phenyl (CAS 13037-56-4)

Rhodanine, 5-benzylidene-3-phenyl

InChI
InChI=1S/C16H11NOS2/c18-15-14(11-12-7-3-1-4-8-12)20-16(19)17(15)13-9-5-2-6-10-13/h1-11H/b14-11+
InChI Key
TZPSGDWUSVAMNF-SDNWHVSQSA-N
Formula
C16H11NOS2
SMILES
O=C1C(=Cc2ccccc2)SC(=S)N1c1ccccc1
Molecular Weight1
297.39
CAS
13037-56-4
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Physical Properties

Property Value Unit Source
ω 0.4993 Relay (1.0) Calculated Property
ΔfG° 221.13 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 261.82 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 105.85 kJ/mol Relay (1.0) Calculated Property
IE 7.52 eV Relay (1.0) Calculated Property
log10WS -5.52 Relay (1.0) Calculated Property
logPoct/wat 4.092 Crippen Calculated Property
McVol 213.570 ml/mol McGowan Calculated Property
Pc 2978.64 kPa Relay (1.0-beta) Calculated Property
Tboil 666.22 K Relay (1.0) Calculated Property
Tc 1007.25 K Relay (1.0) Calculated Property
Tfus 431.27 K Relay (1.0) Calculated Property
Vc 0.725 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Rhodanine, 5-(p-dimethylaminobenzylidene)-3-phenyl. Quinapril desethyl 3Me (Quinaprilate 3Me). 1-Oxo-2-(3-phenylrhodanin-5-ylidene)-3-pyridinium-4-naphthoxide. Quinapril Me. N-Acetylnornarcotine. Carteolol hydroxy, acetylated. Biotin, N,N'-(trimethylsilyl)-, trimethylsilyl ester. Nadolol, N-methyl-, trimethyl ether. Furan, 2-[(2-furyl)-(4-methylphenylamino)methylcarbonyl]. Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. 5-Hydroxy-tetraline-cis-2,3-diol, ferrocenylboronate. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. cis-1,2-Tetralinediol, ferrocenylboronate. Moexipril Me. 1,2,3,4-Tetrahydroanthracene-cis-1,2-diol, ferrocenylboronate.

Find more compounds similar to Rhodanine, 5-benzylidene-3-phenyl.

Sources

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