Basic information
- Name:
2-chloro-N-hydroxy-benzenecarboximidamide
- CAS No.:
56935-60-5
- Molecular Structure:
- Formula:
- C7H7ClN2O
- Molecular Weight:
- 170.6
- Synonyms:
- Benzenecarboximidamide, 2-chloro-N'-hydroxy-;2-Chloro-N'-hydroxybenzenecarboximidamide;2-Chloro-N-Hydroxy-Benzamidine;
- Density:
- 1.36 g/cm3
- Boiling Point:
- 345.4 °C at 760 mmHg
- Flash Point:
- 162.7 °C
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Specification
The CAS register number of 2-chloro-N-hydroxy-benzenecarboximidamide is 56935-60-5. It also can be called as Benzenecarboximidamide, 2-chloro-N'-hydroxy- and the IUPAC name about this chemical is 2-chloro-N'-hydroxybenzenecarboximidamide. The molecular formula about this chemical is C7H7ClN2O and the molecular weight is 170.6. It belongs to the following product categories which include Amidine; Pharmacetical and so on.
Physical properties about 2-chloro-N-hydroxy-benzenecarboximidamide are: (1)ACD/LogP: 1.32; (2)ACD/LogD (pH 5.5): 1.3; (3)ACD/LogD (pH 7.4): 1.32; (4)ACD/BCF (pH 5.5): 5.72; (5)ACD/BCF (pH 7.4): 5.94; (6)ACD/KOC (pH 5.5): 119.85; (7)ACD/KOC (pH 7.4): 124.64; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 24.83Å2; (12)Index of Refraction: 1.6; (13)Molar Refractivity: 42.67 cm3; (14)Molar Volume: 124.6 cm3; (15)Polarizability: 16.91x10-24cm3; (16)Surface Tension: 49.8 dyne/cm; (17)Enthalpy of Vaporization: 62.2 kJ/mol; (18)Boiling Point: 345.4 °C at 760 mmHg; (19)Vapour Pressure: 2.35E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccccc1C(=NO)N
(2)InChI: InChI=1/C7H7ClN2O/c8-6-4-2-1-3-5(6)7(9)10-11/h1-4,11H,(H2,9,10)
(3)InChIKey: QTFXBVGIXZOOAY-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C7H7ClN2O/c8-6-4-2-1-3-5(6)7(9)10-11/h1-4,11H,(H2,9,10)
(5)Std. InChIKey: QTFXBVGIXZOOAY-UHFFFAOYSA-N
