CAS No.33224-23-6,4-METHOXY-3-NITROBENZONITRILE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	33224-23-6
Name:	4-METHOXY-3-NITROBENZONITRILE
Article Data:	5
Cas Database

Formula:	C₈H₆N₂O₃
Molecular Weight:	178.147
Synonyms:	4-Methoxy-3-nitrobenzonitrile;5-Cyano-2-methoxynitrobenzene;p-Anisonitrile,3-nitro- (7CI);
Density:	1.32 g/cm³
Melting Point:	148-150 °C
Boiling Point:	330.2 °C at 760 mmHg
Flash Point:	153.5 °C
Hazard Symbols:	R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system
Risk Codes:	20/21/22-36/37/38
Safety:	26-36/37/39
PSA:	78.84000
LogP:	1.99828

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Specification

The Benzonitrile,4-methoxy-3-nitro- is an organic compound with the formula C₈H₆N₂O₃. The IUPAC name of this chemical is 4-Methoxy-3-nitrobenzonitrile. And the CAS registry number of this chemical is 33224-23-6. Besides, its molecular weight is 178.14.

Physical properties about Benzonitrile,4-methoxy-3-nitro- are: (1)ACD/LogP: 1.25; (2)ACD/LogD (pH 5.5): 1.25; (3)ACD/LogD (pH 7.4): 1.25; (4)ACD/BCF (pH 5.5): 5.26; (5)ACD/BCF (pH 7.4): 5.26; (6)ACD/KOC (pH 5.5): 114.27; (7)ACD/KOC (pH 7.4): 114.27; (8)#H bond acceptors: 5; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 78.84 Å²; (11)Index of Refraction: 1.563; (12)Molar Refractivity: 43.71 cm³; (13)Molar Volume: 134.5 cm³; (14)Polarizability: 17.33×10^-24 cm³; (15)Surface Tension: 56.3 dyne/cm; (16)Density: 1.32 g/cm³; (17)Flash Point: 153.5 °C; (18)Enthalpy of Vaporization: 57.28 kJ/mol; (19)Boiling Point: 330.2 °C at 760 mmHg; (20)Vapour Pressure: 0.000169 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C8H6N2O3/c1-13-8-3-2-6(5-9)4-7(8)10(11)12/h2-4H,1H3
(2)InChIKey: ACAYRJJVKPMSIS-UHFFFAOYAQ
(3)Std. InChI: InChI=1S/C8H6N2O3/c1-13-8-3-2-6(5-9)4-7(8)10(11)12/h2-4H,1H3
(4)Std. InChIKey: ACAYRJJVKPMSIS-UHFFFAOYSA-N