Chemical Properties of 2,3-Dihydro-4-methyl-7-nitro-1H-1,5-benzodiazepin-2-one (CAS 37546-86-4)

2,3-Dihydro-4-methyl-7-nitro-1H-1,5-benzodiazepin-2-one

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InChI
InChI=1S/C10H9N3O3/c1-6-4-10(14)12-8-3-2-7(13(15)16)5-9(8)11-6/h2-3,5H,4H2,1H3,(H,12,14)
InChI Key
XRCMCWYNHVSDJX-UHFFFAOYSA-N
Formula
C10H9N3O3
SMILES
CC1=Nc2cc([N+](=O)[O-])ccc2NC(=O)C1
Molecular Weight1
219.20
CAS
37546-86-4
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Physical Properties

Property Value Unit Source
Δf 308.51 kJ/mol Joback Calculated Property
Δfgas 51.31 kJ/mol Joback Calculated Property
Δfus 34.21 kJ/mol Joback Calculated Property
Δvap 76.78 kJ/mol Joback Calculated Property
log10WS -2.79 Crippen Calculated Property
logPoct/wat 2.029 Crippen Calculated Property
McVol 151.790 ml/mol McGowan Calculated Property
Pc 4056.96 kPa Joback Calculated Property
Tboil 810.84 K Joback Calculated Property
Tc 1100.61 K Joback Calculated Property
Tfus 670.74 K Joback Calculated Property
Vc 0.591 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [443.74; 494.46] J/mol×K [810.84; 1100.61] Show Hide
Cp,gas 443.74 J/mol×K 810.84 Joback Calculated Property
Cp,gas 456.58 J/mol×K 859.14 Joback Calculated Property
Cp,gas 467.71 J/mol×K 907.43 Joback Calculated Property
Cp,gas 477.10 J/mol×K 955.73 Joback Calculated Property
Cp,gas 484.72 J/mol×K 1004.02 Joback Calculated Property
Cp,gas 490.51 J/mol×K 1052.32 Joback Calculated Property
Cp,gas 494.46 J/mol×K 1100.61 Joback Calculated Property

Similar Compounds

2,3-Dihydro-4-methyl-8-nitro-1H-1,5-benzodiazepin-2-one. Morazone. Metergoline. Bialophos, N,O,O-tris(tert-butyldimethylsilyl)deriv.. Dihydromorphinone acetate. Dihydromorphine. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Quinine, trimethylsilyl ether. Acetyldihydrocodeine. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. norbormide. Cytosine arabinoside, dimethyl-allyldimethylsilyl derivative. 2'-Deoxyguanosine, tris(trimethylsilyl) deriv.. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. Methyldihydromorphine.

Find more compounds similar to 2,3-Dihydro-4-methyl-7-nitro-1H-1,5-benzodiazepin-2-one.

Sources

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