Chemical Properties of Benzoic acid, p-(3-methyl-3-nitrosoureido)- (CAS 90349-65-8)

Benzoic acid, p-(3-methyl-3-nitrosoureido)-

InChI
InChI=1S/C9H9N3O4/c1-12(11-16)9(15)10-7-4-2-6(3-5-7)8(13)14/h2-5H,1H3,(H,10,15)(H,13,14)
InChI Key
LUAOYJDDQIIDIN-UHFFFAOYSA-N
Formula
C9H9N3O4
SMILES
CN(N=O)C(=O)Nc1ccc(C(=O)O)cc1
Molecular Weight1
223.19
CAS
90349-65-8
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Physical Properties

Property Value Unit Source
ω 0.9545 Relay (1.0) Calculated Property
ΔfG° -67.47 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -363.80 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 111.83 kJ/mol Relay (1.0) Calculated Property
IE 8.27 eV Relay (1.0) Calculated Property
log10WS -2.20 Relay (1.0) Calculated Property
logPoct/wat 1.530 Crippen Calculated Property
McVol 154.430 ml/mol McGowan Calculated Property
Pc 4135.61 kPa Joback Calculated Property
Tboil 596.83 K Relay (1.0) Calculated Property
Tc 919.05 K Relay (1.0) Calculated Property
Tfus 502.10 K Relay (1.0) Calculated Property
Vc 0.565 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Benzoic acid, p-[3-(2-chloroethyl)-3-nitrosoureido]-. Urea], 1,1'-p-phenylene-bis[3-methyl-3-nitroso-. Urea, 1-(2-chloroethyl)-3-[p-(dimethylcarbamoyl)phenyl]-1-nitroso-. Urea, 3-(p-fluorophenyl)-1-methyl-1-nitroso-. Urea, 3-(p-methoxyphenyl)-1-methyl-1-nitroso-. Anthranilic acid, n-[(2-chloroethyl)nitrosocarbamoyl]-. [4-(([1-(2-Chloroethyl)-2-oxohydrazino]carbonyl)amino)phenyl]acetic acid. Benzoic acid, m-[3-(2-chloroethyl)ureido]-. Benzoic acid, 4-[3-(2-chloroethyl)-3-nitrosoureido]-3,5-dimethyl-. Benzoic acid, 4-(trifluoroacetylamino)-. Urea, 1-(2',4'-di-tert-butylphenyl)-3,3-dimethyl-. Urea, 1,1'-p-phenylenebis[3-(2-fluoroethyl)-3-nitroso-. Deanol acetamidobenzoate. Acedoben. Urea, 1-(2-chloroethyl)-3-[p-(dimethylcarbamoyl)phenyl]-.

Find more compounds similar to Benzoic acid, p-(3-methyl-3-nitrosoureido)-.

Sources

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