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Basic Information
CAS No.: 915707-41-4
Name: 4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile
Molecular Structure:
Molecular Structure of 915707-41-4 (4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile)
Formula: C11H9N3
Molecular Weight: 183.21
Synonyms: 4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile;4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile 97%
Density: 1.11 g/cm3
Melting Point: 146 °C
Boiling Point: 356.4 °C at 760 mmHg
Flash Point: 169.4 °C
PSA: 41.61000
LogP: 1.95878
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  • 4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile

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    915707-41-4

    4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile

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    Hangzhou ZeErRui Chemical Co., Ltd. located in Lingang industrial areas, our plant covers an area of 6000 square meters.ZeErRui dedicated to the development, production and marketing of chemicals. We have earned ourselves a good reputation at home an

    Hangzhou ZeErRui Chemical Co., Ltd. located in Lingang industrial areas, our plant covers an area of 6000 square meters.ZeErRui dedicated to the development, production and marketi

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  • 4-(1-METHYL-1H-PYRAZOL-3-YL)BENZONITRILE

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    4-(1-METHYL-1H-PYRAZOL-3-YL)BENZONITRILE

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    4-(1-METHYL-1H-PYRAZOL-3-YL)BENZONITRILEAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

    Welcome to Hangzhou Fandachem Co.,Ltd (www.FandaChem.com) Hangzhou Fandachem Co.,Ltd (Fandachem),an experienced and professional China-based Fine Chemical supplier. We supply the

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  • 4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile

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    915707-41-4

    4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile

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    Stable factory laboratory supply support, technical research and development Application:api

    Hangyu Biotech is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and O

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    FT-0728235

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    High Quality Best Price Storage:Store in dry, dark and ventilated place Application:Chemical Synthesis Intermediate

    Finetech Industry Limited is a company in England,which specializing in developing, manufacturing and marketing fine organic compounds and intermediates for the fine chemical and p

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Specification

This chemical is called Benzonitrile, 4-(1-methyl-1H-pyrazol-3-yl)-, and its systematic name is 4-(1-methylpyrazol-3-yl)benzonitrile. With the molecular formula of C11H9N3, its molecular weight is 183.21. The CAS registry number of this chemical is 915707-41-4.

Other characteristics of the Benzonitrile, 4-(1-methyl-1H-pyrazol-3-yl)- can be summarised as followings: (1)ACD/LogP: 1.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.24; (4)ACD/LogD (pH 7.4): 1.24; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 41.61 Å2; (9)Index of Refraction: 1.61; (10)Molar Refractivity: 56.87 cm3; (11)Molar Volume: 164 cm3; (12)Polarizability: 22.54×10-24cm3; (13)Surface Tension: 44.2 dyne/cm; (14)Density: 1.11 g/cm3; (15)Flash Point: 169.4 °C; (16)Enthalpy of Vaporization: 60.17 kJ/mol; (17)Boiling Point: 356.4 °C at 760 mmHg; (18)Vapour Pressure: 2.92E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Cn1ccc(n1)c2ccc(cc2)C#N
2.InChI: InChI=1/C11H9N3/c1-14-7-6-11(13-14)10-4-2-9(8-12)3-5-10/h2-7H,1H3
3.InChIKey: OGJIPYGVYSEOQL-UHFFFAOYAF