Chemical Properties of 5-chloro-2-(5-chloro-7-methyl-3-oxobenzo[b]thien-2(3H)-ylidene)-7-methylbenzo[b]thiophene-3(2H)-one (CAS 5462-29-3)

5-chloro-2-(5-chloro-7-methyl-3-oxobenzo[b]thien-2(3H)-ylidene)-7-methylbenzo[b]thiophene-3(2H)-one

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InChI
InChI=1S/C18H10Cl2O2S2/c1-7-3-9(19)5-11-13(21)17(23-15(7)11)18-14(22)12-6-10(20)4-8(2)16(12)24-18/h3-6H,1-2H3/b18-17+
InChI Key
HUGACAUYNJDGTB-ISLYRVAYSA-N
Formula
C18H10Cl2O2S2
SMILES
Cc1cc(Cl)cc2c1SC(=C1Sc3c(C)cc(Cl)cc3C1=O)C2=O
Molecular Weight1
393.31
CAS
5462-29-3
Other Names
  • 5-Chloro-2-(5-chloro-7-methyl-3-oxobenzo[b]thien-2(3H)-ylidine)-7-methyl-benzo[b]thiophen-3(2H)-one (C.I. Vat Violet 2)
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Physical Properties

Property Value Unit Source
Δf 226.02 kJ/mol Joback Calculated Property
Δfgas -5.85 kJ/mol Joback Calculated Property
Δfus 37.42 kJ/mol Joback Calculated Property
Δvap 95.13 kJ/mol Joback Calculated Property
log10WS -8.05 Crippen Calculated Property
logPoct/wat 6.099 Crippen Calculated Property
McVol 251.260 ml/mol McGowan Calculated Property
Pc 2361.07 kPa Joback Calculated Property
Tboil 1032.58 K Joback Calculated Property
Tc 1327.16 K Joback Calculated Property
Tfus 853.92 K Joback Calculated Property
Vc 0.933 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [676.32; 724.55] J/mol×K [1032.58; 1327.16] Show Hide
Cp,gas 676.32 J/mol×K 1032.58 Joback Calculated Property
Cp,gas 686.59 J/mol×K 1081.68 Joback Calculated Property
Cp,gas 695.84 J/mol×K 1130.77 Joback Calculated Property
Cp,gas 704.18 J/mol×K 1179.87 Joback Calculated Property
Cp,gas 711.68 J/mol×K 1228.97 Joback Calculated Property
Cp,gas 718.44 J/mol×K 1278.06 Joback Calculated Property
Cp,gas 724.55 J/mol×K 1327.16 Joback Calculated Property
ΔsubH 93.00 kJ/mol 576.50 NIST

Similar Compounds

Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl. 5-Methyluridine, tris(trifluoroacetate). Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-TFA. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TFA. Pinobanksin-3-pentanoate, bis-TMS. Pinobanksin-3-isobutanoate, bis-TMS. 7-Angeloyl-1-formyl-6,7-dihydro-5H-pyrrolizine. Thymidine, 3'-O-TFA, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-TBDMS. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TBDMS. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-TMS. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TMS.

Find more compounds similar to 5-chloro-2-(5-chloro-7-methyl-3-oxobenzo[b]thien-2(3H)-ylidene)-7-methylbenzo[b]thiophene-3(2H)-one.

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