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51209-78-0

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Basic Information
CAS No.: 51209-78-0
Name: METHYL 2-METHYLHEPTANOATE
Article Data: 6
Molecular Structure:
Molecular Structure of 51209-78-0 (METHYL 2-METHYLHEPTANOATE)
Formula: C9H18O2
Molecular Weight: 158.241
Synonyms: 2-Methylheptanoicacid methyl ester;Methyl 2-methylheptanoate;2-Methylheptanoic acid methyl ester;
Density: 0.874 g/cm3
Boiling Point: 176.5 °C at 760 mmHg
Flash Point: 59.4 °C
PSA: 26.30000
LogP: 2.37580
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  • Heptanoic acid,2-methyl-, methyl ester

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    51209-78-0

    Heptanoic acid,2-methyl-, methyl ester

    Min.Order: 1 Gram

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    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and OLED intermediates and other fine chemicals. W

    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, s

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  • Heptanoic acid,2-methyl-, methyl ester

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    51209-78-0

    Heptanoic acid,2-methyl-, methyl ester

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    hight degree of purity Application:Fine chemical intermediates, used as the main raw material for fluorhe synthesis of various pesticides, medicines, surfactants, polymer monomers, nd ntifungal agents

    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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  • METHYL 2-METHYLHEPTANOATE

  • Casno:

    51209-78-0

    METHYL 2-METHYLHEPTANOATE

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    factory?direct?saleAppearance:White powder Storage:Sealed and preserved Package:200/Kilograms Application:healing drugs Transportation:By sea Port:Shanghai/tianjin

    Zhejiang Jiuzhou Chemical Co.,Ltd is a market-oriented and innovation-driven biopharmaceutical company. The company is focusing on the R&D, manufacturing and sales of pharmaceutica

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Specification

The Heptanoic acid,2-methyl-, methyl ester, with the CAS registry number 51209-78-0, is also known as 2-Methylheptanoic acid methyl ester. This chemical's molecular formula is C9H18O2 and molecular weight is 158.24. What's more, its systematic name is Methyl 2-methylheptanoate.

Physical properties about Heptanoic acid,2-methyl-, methyl ester are: (1)ACD/LogP: 3.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.18; (4)ACD/LogD (pH 7.4): 3.18; (5)ACD/BCF (pH 5.5): 154.05; (6)ACD/BCF (pH 7.4): 154.05; (7)ACD/KOC (pH 5.5): 1280.97; (8)ACD/KOC (pH 7.4): 1280.97; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.416; (14)Molar Refractivity: 45.47 cm3; (15)Molar Volume: 180.9 cm3; (16)Polarizability: 18.02×10-24 cm3; (17)Surface Tension: 26.9 dyne/cm; (18)Density: 0.874 g/cm3; (19)Flash Point: 59.4 °C; (20)Enthalpy of Vaporization: 41.28 kJ/mol; (21)Boiling Point: 176.5 °C at 760 mmHg; (22)Vapour Pressure: 1.09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)C(CCCCC)C
(2)InChI: InChI=1/C9H18O2/c1-4-5-6-7-8(2)9(10)11-3/h8H,4-7H2,1-3H3
(3)InChIKey: FUZYFWJHBYRPIP-UHFFFAOYAU