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CAS No.: | 139277-58-0 |
---|---|
Name: | 4-BIPHENYLACETIC ACID HYDRAZIDE |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C14H14N2O |
Molecular Weight: | 226.27 |
Synonyms: | 4-Biphenylaceticacid hydrazide;2-(Biphenyl-4-yl)acetohydrazide;2-(1,1'-Biphenyl-4-yl)acetohydrazide; |
Density: | 1.147 g/cm3 |
Boiling Point: | 473.9 °C at 760 mmHg |
Flash Point: | 240.4 °C |
Hazard Symbols: | Xi |
Risk Codes: | Xi:; "> Xi:; |
PSA: | 55.12000 |
LogP: | 2.97720 |
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This chemical is called [1,1'-Biphenyl]-4-aceticacid, hydrazide, and it can also be named as 4-Biphenylacetic hydrazide. With the molecular formula of C14H14N2O, its molecular weight is 226.27. The CAS registry number of this chemical is 139277-58-0, and its systematic name is 2-Biphenyl-4-ylacetohydrazide.
Other characteristics of the [1,1'-Biphenyl]-4-aceticacid, hydrazide can be summarised as followings: (1)ACD/LogP: 1.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.89; (4)ACD/LogD (pH 7.4): 1.9; (5)ACD/BCF (pH 5.5): 16.2; (6)ACD/BCF (pH 7.4): 16.26; (7)ACD/KOC (pH 5.5): 255.25; (8)ACD/KOC (pH 7.4): 256.16; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 23.55 Å2; (13)Index of Refraction: 1.601; (14)Molar Refractivity: 67.55 cm3; (15)Molar Volume: 197.1 cm3; (16)Polarizability: 26.78×10-24 cm3; (17)Surface Tension: 48.1 dyne/cm; (18)Density: 1.147 g/cm3; (19)Flash Point: 240.4 °C; (20)Enthalpy of Vaporization: 73.71 kJ/mol; (21)Boiling Point: 473.9 °C at 760 mmHg; (22)Vapour Pressure: 3.79E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(NN)Cc1ccc(cc1)c2ccccc2
2.InChI: InChI=1/C14H14N2O/c15-16-14(17)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10,15H2,(H,16,17)
3.InChIKey: MLSJQOUEHHYKAD-UHFFFAOYAU