Chemical Properties of [4-(([1-(2-Chloroethyl)-2-oxohydrazino]carbonyl)amino)phenyl]acetic acid (CAS 13909-29-0)

[4-(([1-(2-Chloroethyl)-2-oxohydrazino]carbonyl)amino)phenyl]acetic acid

InChI
InChI=1S/C11H12ClN3O4/c12-5-6-15(14-19)11(18)13-9-3-1-8(2-4-9)7-10(16)17/h1-4H,5-7H2,(H,13,18)(H,16,17)
InChI Key
ISHRKCISRZYJGC-UHFFFAOYSA-N
Formula
C11H12ClN3O4
SMILES
O=NN(CCCl)C(=O)Nc1ccc(CC(=O)O)cc1
Molecular Weight1
285.68
CAS
13909-29-0
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Physical Properties

Property Value Unit Source
ω 1.0431 Relay (1.0) Calculated Property
ΔfG° -82.11 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -437.69 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 108.67 kJ/mol Relay (1.0) Calculated Property
IE 8.06 eV Relay (1.0) Calculated Property
log10WS -2.77 Relay (1.0) Calculated Property
logPoct/wat 2.068 Crippen Calculated Property
McVol 194.850 ml/mol McGowan Calculated Property
Pc 3142.03 kPa Joback Calculated Property
Tboil 630.32 K Relay (1.0) Calculated Property
Tc 949.84 K Relay (1.0) Calculated Property
Tfus 420.88 K Relay (1.0) Calculated Property
Vc 0.680 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Benzoic acid, p-[3-(2-chloroethyl)-3-nitrosoureido]-. Urea, 1-(2-chloroethyl)-3-[p-(dimethylcarbamoyl)phenyl]-1-nitroso-. Sodium penicillin g. Pinobanksin-3-isobutanoate, bis-TMS. «delta»1-tetrahydrocannabinolic acid, phenyl-boronate. Aflatoxin B1. Pinobanksin-3-propanoate, bis-TMS. Pinobanksin-3-acetate, bis-TMS. propyl-«delta»1-tetrahydrocannabinolic acid, TMS. Mirtazapine-M (HO-) AC. Mirtazapine-M (nor-HO-methoxy-) 2AC. Mirtazapine-M (nor-HO-) 2AC. «delta»1-tetrahydrocannabinolic acid, TMS. «delta»1-tetrahydrocannabinolic acid, n-butyl-boronate. propyl-«delta»1-tetrahydrocannabinolic acid, n-butyl-boronate.

Find more compounds similar to [4-(([1-(2-Chloroethyl)-2-oxohydrazino]carbonyl)amino)phenyl]acetic acid.

Sources

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