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912569-60-9

Basic Information
CAS No.: 912569-60-9
Name: 3-(1-Methyl-1H-pyrazol-3-yl)phenyl isocyanate
Molecular Structure:
Molecular Structure of 912569-60-9 (3-(1-Methyl-1H-pyrazol-3-yl)phenyl isocyanate)
Formula: C11H9N3O
Molecular Weight: 199.212
Synonyms: 3-(1-Methyl-1H-pyrazol-3-yl)phenyl isocyanate;3-(3-Isocyanatophenyl)-1-methyl-1H-pyrazole;3-(1-Methyl-1H-pyrazol-3-yl)phenyl isocyanate 97%;3-(3-Isocyanatophenyl)-1-methyl-1H-pyrazole 97%
Density: 1.17 g/cm3
Boiling Point: 352.3 °C at 760 mmHg
Flash Point: 166.9 °C
PSA: 47.25000
LogP: 2.05440
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  • 3-(3-Isocyanatophenyl)-1-methyl-1H-pyrazole , 97%

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    912569-60-9

    3-(3-Isocyanatophenyl)-1-methyl-1H-pyrazole , 97%

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    Ansciep Chemical is a professional enterprise manufacturing and distributing fine chemicals and speciality chemicals. We have been dedicated to heterocycle compounds and phenyl rings for tens of years. This is our mature product for export. Our quali

    Antimex Chemical Limied, was founded in 2001, we are specializing in manufacturing & researching of Active pharmaceutical Ingredients,Veterinary pharm APIs,cosmetic ingredients,and

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  • 3-(3-ISOCYANATOPHENYL)-1-METHYL-1H-PYRAZOLE

  • Casno:

    912569-60-9

    3-(3-ISOCYANATOPHENYL)-1-METHYL-1H-PYRAZOLE

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    3-(3-ISOCYANATOPHENYL)-1-METHYL-1H-PYRAZOLEAppearance: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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Specification

This chemical is called 1H-Pyrazole, 3-(3-isocyanatophenyl)-1-methyl-, and its systematic name is 3-(3-isocyanatophenyl)-1-methyl-pyrazole. With the molecular formula of C11H9N3O, its molecular weight is . The CAS registry number of this chemical is 199.21.

Other characteristics of the 1H-Pyrazole, 3-(3-isocyanatophenyl)-1-methyl- can be summarised as followings: (1)ACD/LogP: 2.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.35; (4)ACD/LogD (pH 7.4): 2.35 ; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 47.25 Å2; (9)Index of Refraction: 1.612; (10)Molar Refractivity: 58.87 cm3; (11)Molar Volume: 169.2 cm3; (12)Polarizability: 23.33×10-24cm3; (13)Surface Tension: 46.1 dyne/cm; (14)Density: 1.17 g/cm3; (15)Flash Point: 166.9 °C; (16)Enthalpy of Vaporization: 59.71 kJ/mol; (17)Boiling Point: 352.3 °C at 760 mmHg; (18)Vapour Pressure: 3.87E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Cn1ccc(n1)c2cccc(c2)N=C=O
2.InChI: InChI=1/C11H9N3O/c1-14-6-5-11(13-14)9-3-2-4-10(7-9)12-8-15/h2-7H,1H3
3.InChIKey: TWBLKMXEBFQFKR-UHFFFAOYAN