Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Hydrazinecarboxamide,2-(1-phenylethylidene)- |
EINECS | N/A |
CAS No. | 2492-30-0 | Density | 1.16 g/cm3 |
PSA | 67.48000 | LogP | 2.17010 |
Solubility | N/A | Melting Point |
207~209℃ |
Formula | C9H11N3O | Boiling Point | N/A |
Molecular Weight | 177.206 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | 36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(1-Phenylethylidene)hydrazinecarboxamide;AI3-16976;Acetophenone semicarbazone;NSC 21616;Hydrazinecarboxamide, 2-(1-phenylethylidene)- (9CI);(1-Phenylethylideneamino)urea; |
Article Data | 26 |
The Hydrazinecarboxamide,2-(1-phenylethylidene)- with CAS registry number of 2492-30-0 is also known as Acetophenone semicarbazone. The IUPAC name is (1-Phenylethylideneamino)urea. In addition, the formula is C9H11N3O and the molecular weight is 177.20.
Physical properties about Hydrazinecarboxamide,2-(1-phenylethylidene)- are: (1)ACD/LogP: 0.71; (2)ACD/LogD (pH 5.5): 0.71; (3)ACD/LogD (pH 7.4): 0.71; (4)ACD/BCF (pH 5.5): 2.06; (5)ACD/BCF (pH 7.4): 2.06; (6)ACD/KOC (pH 5.5): 58.29; (7)ACD/KOC (pH 7.4): 58.28; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.576; (12)Molar Refractivity: 50.16 cm3; (13)Molar Volume: 151.5 cm3; (14)Surface Tension: 44.7 dyne/cm; (15)Density: 1.16 g/cm3.
Uses of Hydrazinecarboxamide,2-(1-phenylethylidene)-: it is used to produce 4-phenyl-[1,2,3]thiadiazole. The reaction occurs with reagent SOCl2 at ambient temperature. The yield is about 90%.
You can still convert the following datas into molecular structure:
1. Canonical SMILES: CC(=NNC(=O)N)C1=CC=CC=C1
2. InChI: InChI=1S/C9H11N3O/c1-7(11-12-9(10)13)8-5-3-2-4-6-8/h2-6H,1H3,(H3,10,12,13)
3. InChIKey: CPXYGYOMIMOSCX-UHFFFAOYSA-N
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LDLo | intraperitoneal | 500mg/kg (500mg/kg) | "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 9, Pg. 128, 1957. |