Chemical Properties of 1,3,7,9-Tetranitrophenothiazine,5-oxide (CAS 27050-53-9)

1,3,7,9-Tetranitrophenothiazine,5-oxide

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InChI
InChI=1S/C12H5N5O9S/c18-14(19)5-1-7(16(22)23)11-9(3-5)27(26)10-4-6(15(20)21)2-8(17(24)25)12(10)13-11/h1-4,13H
InChI Key
MACCEORDICAAII-UHFFFAOYSA-N
Formula
C12H5N5O9S
SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c2c(c1)S(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N2
Molecular Weight1
395.26
CAS
27050-53-9
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Physical Properties

Property Value Unit Source
Δcsolid -5540.74 kJ/mol NIST
Δf 316.70 kJ/mol Joback Calculated Property
Δfgas 4.95 kJ/mol Joback Calculated Property
Δfsolid -498.01 kJ/mol NIST
Δfus 74.06 kJ/mol Joback Calculated Property
Δvap 135.72 kJ/mol Joback Calculated Property
log10WS -5.29 Crippen Calculated Property
logPoct/wat 2.543 Crippen Calculated Property
McVol 223.440 ml/mol McGowan Calculated Property
Pc 4305.56 kPa Joback Calculated Property
Tboil 1257.58 K Joback Calculated Property
Tc 1572.83 K Joback Calculated Property
Tfus 1143.66 K Joback Calculated Property
Vc 0.904 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [655.45; 701.51] J/mol×K [1257.58; 1572.83] Show Hide
Cp,gas 655.45 J/mol×K 1257.58 Joback Calculated Property
Cp,gas 662.11 J/mol×K 1310.12 Joback Calculated Property
Cp,gas 668.91 J/mol×K 1362.66 Joback Calculated Property
Cp,gas 676.06 J/mol×K 1415.20 Joback Calculated Property
Cp,gas 683.74 J/mol×K 1467.74 Joback Calculated Property
Cp,gas 692.16 J/mol×K 1520.29 Joback Calculated Property
Cp,gas 701.51 J/mol×K 1572.83 Joback Calculated Property

Similar Compounds

Zidovudine. 1-Methyl-4-piperidyl cyclohexylphenylglycolate. 5-Methyluridine, tris(trifluoroacetate). Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TFA. narwedine. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-TFA. 6-Tetrahydrocannabinol, 7-hydroxy, allyl-DMS. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. Mandelic acid, «alpha»-cyclopentyl-, 1-methyl-4-piperidyl ester. Cyclopentyl-hydroxy-phenyl-acetic acid 1-methyl-pyrrolidin-3-yl ester. 5-Methyluridine, 2',3',5'-tris-O-TBDMS. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TBDMS.

Find more compounds similar to 1,3,7,9-Tetranitrophenothiazine,5-oxide.

Sources

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