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69194-89-4

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Basic Information
CAS No.: 69194-89-4
Name: 4-(4-CHLOROPHENYL)SEMICARBAZIDE
Article Data: 29
Molecular Structure:
Molecular Structure of 69194-89-4 (4-(4-CHLOROPHENYL)SEMICARBAZIDE)
Formula: C7H8ClN3O
Molecular Weight: 185.613
Synonyms: Semicarbazide,4-(p-chlorophenyl)- (7CI);N-(4-Chlorophenyl)hydrazine carboxamide;(4-Chlorophenyl)semicarbazide;1-Amino-3-(4-chlorophenyl)urea;3-Amino-1-(4-chlorophenyl)urea;N-(4-Chlorophenyl)-1-hydrazinecarboxamide;
Density: 1.422 g/cm3
PSA: 67.15000
LogP: 2.49940
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Specification

The Hydrazinecarboxamide,N-(4-chlorophenyl)- with CAS registry number of 69194-89-4 is also known as Semicarbazide,4-(p-chlorophenyl)- (7CI). The systematic name is N-(4-Chlorophenyl)hydrazine carboxamide. In addition, the formula is C7H8ClN3O and the molecular weight is 185.61.

Physical properties about Hydrazinecarboxamide,N-(4-chlorophenyl)- are: (1)ACD/LogP: 0.87; (2)ACD/LogD (pH 5.5): 0.87; (3)ACD/LogD (pH 7.4): 0.87; (4)ACD/BCF (pH 5.5): 2.69; (5)ACD/BCF (pH 7.4): 2.69; (6)ACD/KOC (pH 5.5): 70.57; (7)ACD/KOC (pH 7.4): 70.73; (8)#H bond acceptors: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.655; (12)Molar Refractivity: 47.91 cm3; (13)Molar Volume: 130.4 cm3; (14)Surface Tension: 60.6 dyne/cm; (15)Density: 1.422 g/cm3.

Preparation of Hydrazinecarboxamide,N-(4-chlorophenyl)-: it is prepared by reaction of 3-(4-chloro-phenyl)-5-(4-methoxy-benzylidene)-thiazolidine-2,4-dione. The reaction needs reagent 99% N2H4*H2O and solvent ethanol with other condition of heating for 12 hours. The yield is about 50%.

Hydrazinecarboxamide,N-(4-chlorophenyl)- is prepared by reaction of 3-(4-chloro-phenyl)-5-(4-methoxy-benzylidene)-thiazolidine-2,4-dione.

Uses of Hydrazinecarboxamide,N-(4-chlorophenyl)-: it is used to produce NSC 680933 by condensation reaction with naphthalene-1-carbaldehyde. The reaction occurs with solvent ethanol with other condition of heating. The yield is about 59%.

Hydrazinecarboxamide,N-(4-chlorophenyl)- is used to produce NSC 680933 by condensation reaction with naphthalene-1-carbaldehyde.

You can still convert the following datas into molecular structure:
1. SMILES: Clc1ccc(NC(=O)NN)cc1
2. InChI: InChI=1/C7H8ClN3O/c8-5-1-3-6(4-2-5)10-7(12)11-9/h1-4H,9H2,(H2,10,11,12)
3. InChIKey: OXFKGEPYTJGZOZ-UHFFFAOYAM
4. Std. InChI: InChI=1S/C7H8ClN3O/c8-5-1-3-6(4-2-5)10-7(12)11-9/h1-4H,9H2,(H2,10,11,12)
5. Std. InChIKey: OXFKGEPYTJGZOZ-UHFFFAOYSA-N