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51742-11-1

Basic Information
CAS No.: 51742-11-1
Name: 6-ACETYL-3-METHYL-2-CYCLOHEXENE-1-ONE
Article Data: 3
Molecular Structure:
Molecular Structure of 51742-11-1 (6-ACETYL-3-METHYL-2-CYCLOHEXENE-1-ONE)
Formula: C9H12O2
Molecular Weight: 152.193
Synonyms: 6-Acetyl-3-methyl-2-cyclohexen-1-one;NSC 75758;
Density: 1.046 g/cm3
Boiling Point: 264.5 °C at 760 mmHg
Flash Point: 97.8 °C
PSA: 34.14000
LogP: 1.50080
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  • 2-Cyclohexen-1-one,6-acetyl-3-methyl-

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    51742-11-1

    2-Cyclohexen-1-one,6-acetyl-3-methyl-

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    We are a Union of chemistry in China, consists of chemists,engineers, laboratories,factories in China. We organize surplus capacity of R&D and production in China for chemicals cus

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  • 2-Cyclohexen-1-one,6-acetyl-3-methyl-

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    2-Cyclohexen-1-one,6-acetyl-3-methyl-

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  • 6-ACETYL-3-METHYL-2-CYCLOHEXENE-1-ONE

  • Casno:

    51742-11-1

    6-ACETYL-3-METHYL-2-CYCLOHEXENE-1-ONE

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    FINETECH INDUSTRY LIMITED is a LONDON based CRO company providing drug discovery & development services to worldwide clients. FINETECH INDUSTRY LIMITED supplies the 6-ACETYL-3-METHYL-2-CYCLOHEXENE-1-ONE, CAS:51742-11-1 with the most competitive price

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Specification

The 2-Cyclohexen-1-one, 6-acetyl-3-methyl-, with the CAS registry number 51742-11-1, is also known as 6-Acetyl-3-methyl-2-cyclohexene-1-one. This chemical's molecular formula is C9H12O2 and molecular weight is 152.19. What's more, its IUPAC name is 6-Acetyl-3-methylcyclohex-2-en-1-one.

Physical properties about 2-Cyclohexen-1-one, 6-acetyl-3-methyl- are: (1)ACD/LogP: 0.44; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 34.14 Å2; (7)Index of Refraction: 1.479; (8)Molar Refractivity: 41.31 cm3; (9)Molar Volume: 145.4 cm3; (10)Polarizability: 16.37×10-24 cm3; (11)Surface Tension: 34.6 dyne/cm; (12)Density: 1.046 g/cm3; (13)Flash Point: 97.8 °C; (14)Enthalpy of Vaporization: 50.24 kJ/mol; (15)Boiling Point: 264.5 °C at 760 mmHg; (16)Vapour Pressure: 0.00965 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C1\C=C(/CCC1C(=O)C)C
(2) InChI: InChI=1/C9H12O2/c1-6-3-4-8(7(2)10)9(11)5-6/h5,8H,3-4H2,1-2H3
(3) InChIKey: CRHGSBGMOSDOKP-UHFFFAOYAO