Chemical Properties of Benzoic acid, m-[3-(2-chloroethyl)ureido]- (CAS 13908-45-7)

Benzoic acid, m-[3-(2-chloroethyl)ureido]-

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InChI
InChI=1S/C10H11ClN2O3/c11-4-5-12-10(16)13-8-3-1-2-7(6-8)9(14)15/h1-3,6H,4-5H2,(H,14,15)(H2,12,13,16)
InChI Key
SSRMHTGBJOCURP-UHFFFAOYSA-N
Formula
C10H11ClN2O3
SMILES
O=C(NCCCl)Nc1cccc(C(=O)O)c1
Molecular Weight1
242.66
CAS
13908-45-7
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Physical Properties

Property Value Unit Source
Δf -91.71 kJ/mol Joback Calculated Property
Δfgas -310.86 kJ/mol Joback Calculated Property
Δfus 36.99 kJ/mol Joback Calculated Property
Δvap 88.22 kJ/mol Joback Calculated Property
log10WS -2.47 Crippen Calculated Property
logPoct/wat 1.745 Crippen Calculated Property
McVol 169.210 ml/mol McGowan Calculated Property
Pc 3650.93 kPa Joback Calculated Property
Tboil 797.55 K Joback Calculated Property
Tc 1009.55 K Joback Calculated Property
Tfus 537.32 K Joback Calculated Property
Vc 0.637 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [451.98; 493.87] J/mol×K [797.55; 1009.55] Show Hide
Cp,gas 451.98 J/mol×K 797.55 Joback Calculated Property
Cp,gas 460.53 J/mol×K 832.88 Joback Calculated Property
Cp,gas 468.41 J/mol×K 868.22 Joback Calculated Property
Cp,gas 475.65 J/mol×K 903.55 Joback Calculated Property
Cp,gas 482.28 J/mol×K 938.88 Joback Calculated Property
Cp,gas 488.35 J/mol×K 974.21 Joback Calculated Property
Cp,gas 493.87 J/mol×K 1009.55 Joback Calculated Property

Similar Compounds

Anthranilic acid, n-[(chloroethyl)carbamoyl]-. Urea, 1-(2-chloroethyl)-3-[p-(dimethylcarbamoyl)phenyl]-. Anthranilic acid, n-[(2-chloroethyl)nitrosocarbamoyl]-. Urea, 1-(4-acetylphenyl)-3-(2-chloroethyl)-. Urea, 1-(2-chloroethyl)-3-(5,6,7,8-tetrahydro-2-naphthyl)-. Benzoic acid, 4-[3-(2-chloroethyl)ureido]-3,5-dimethyl-. Fominoben. Uracil, 1-{p-[3-(2-chloroethyl)ureido]benzyl}-. Spiro[2H-1-benzopyran-2,2'-[2H]indole], 1',3'-dihydro-1',3',3'-trimethyl-6-nitro-. vasicinone. Shinflavanone. 2-Amino-1-propanol, ferrocenylboronate. Nicolaioidesin B. Griseofulvin. 2-Methyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cyclohepten-7-ol, acetate.

Find more compounds similar to Benzoic acid, m-[3-(2-chloroethyl)ureido]-.

Sources

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