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Basic Information
CAS No.: 1088994-22-2
Name: 5-methyl-2-(pyrimidin-2-yl)benzoic acid
Article Data: 10
Molecular Structure:
Molecular Structure of 1088994-22-2 (5-methyl-2-(pyrimidin-2-yl)benzoic acid)
Formula: C12H10N2O2
Molecular Weight: 214.224
Synonyms: 5-Methyl-2-(pyrimidin-2-yl)benzoic acid;5-Methyl-2-pyrimidin-2-ylbenzoic acid;
Density: 1.26 g/cm3
Boiling Point: 315.514 °C at 760 mmHg
Flash Point: 144.618 °C
Appearance: white crystal powder
PSA: 63.08000
LogP: 2.15020
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    Being efficient R&D company for years, YOUZH warmly welcomes you to our factory for on-site audit!Appearance:SOLID Package:Generally in drums Application:Sound customized scale to meet CMO/CRO need, grams to tons. Port:Shanghai

    Suzhou Youzhihe Medical Science and Technology Co., Ltd. was founded in 2018 with its headquarter located in Suzhou. As international supplier,we develop and manufacture pharmaceut

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  • 5-Methyl-2-(pyrimidin-2-yl)benzoicacid

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    1088994-22-2

    5-Methyl-2-(pyrimidin-2-yl)benzoicacid

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    5-methyl-2-pyrimidin-2`-yl-benzoic acid can be used as intermediates to synthesize other pharmaceutical materials. Because of advanc…

    Established in 1996, Concord Technology (Tianjin) Co., Ltd. is a manufacturer specialized in the research, development and production of high purity chemical reagents and pharmaceu

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  • 5-methyl-2-(pyrimidin-2-yl)benzoic acid

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    1088994-22-2

    5-methyl-2-(pyrimidin-2-yl)benzoic acid

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    stock，low price，high quality，high purity，good sevice Application:R&D

    Shanghai Send Pharmaceutical Technology Co., Ltd(Send Pharm) is a high-tech company specializing in R&D and manufacturing of APIs and pharmaceutical intermediates, and also provi

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  • 5-Methyl-2-(pyrimidin-2-yl)benzoicacid

  • Casno:

    1088994-22-2

    5-Methyl-2-(pyrimidin-2-yl)benzoicacid

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    Comprehensive range product, High quality, Quick shippment, COA with spectras Package:1g Application:pharmaceutical industry, food industry, research

    SHANGHAI ZZBIO CO. LTD. is a high-tech enterprise involved in oligosaccharides & polysaccharides, PEG & PEGylation and phytochemicals for customers in pharmaceutical industry, food

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Specification

The Benzoic acid, 5-methyl-2-(2-pyrimidinyl)-, with the CAS registry number 1088994-22-2, is also known as 5-Methyl-2-pyrimidin-2-ylbenzoic acid. This chemical's molecular formula is C12H10N2O2 and molecular weight is 214.22. What's more, its systematic name is 5-methyl-2-pyrimidin-2-yl-benzoic acid. 

Physical properties of Benzoic acid, 5-methyl-2-(2-pyrimidinyl)- are: (1)ACD/LogP: 1.19; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1.363; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 63.08 Å2; (11)Index of Refraction: 1.608; (12)Molar Refractivity: 58.782 cm3; (13)Molar Volume: 169.97 cm3; (14)Polarizability: 23.303×10-24cm3; (15)Surface Tension: 57.821 dyne/cm; (16)Density: 1.26 g/cm3; (17)Flash Point: 144.618 °C; (18)Enthalpy of Vaporization: 58.782 kJ/mol; (19)Boiling Point: 315.514 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(c(c1)C(=O)O)c2ncccn2
(2)InChI: InChI=1S/C12H10N2O2/c1-8-3-4-9(10(7-8)12(15)16)11-13-5-2-6-14-11/h2-7H,1H3,(H,15,16)
(3)InChIKey: WKBKHXGASBZRMI-UHFFFAOYSA-N