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1009-14-9

Basic Information
CAS No.: 1009-14-9
Name: 1-Pentanone, 1-phenyl-
Article Data: 359
Cas Database
Molecular Structure:
Molecular Structure of 1009-14-9 (1-Pentanone, 1-phenyl-)
Formula: C11H14O
Molecular Weight: 162.232
Synonyms: Valerophenone(6CI,7CI,8CI);1-Phenyl-1-pentanone;Butyl phenyl ketone;NSC 58959;Pentanophenone;Phenyl butyl ketone;n-Butyl phenyl ketone;n-Valerophenone;1-phenylpentan-1-one;
EINECS: 213-767-3
Density: 0.951 g/cm3
Melting Point: -9 °C
Boiling Point: 248.5 °C at 760 mmHg
Flash Point: 99.7 °C
Solubility: Insoluble in water.
Appearance: colourless liquid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 22-24/25-36-26
Transport Information: N/A
PSA: 17.07000
LogP: 3.05950
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  • 99.5% Organic Synthesis Valerophenone 1-Phenyl-1-pentanone CAS 1009-14-9

  • Casno:

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  • Casno:

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  • High purity Valerophenone suppliers in China CAS NO.1009-14-9

  • Casno:

    1009-14-9

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Specification

The 1-Pentanone, 1-phenyl-, with the CAS registry number 1009-14-9 and EINECS registry number 213-767-3, has the systemaic name of 1-phenylpentan-1-one. And the molecular formula of this chemical is C11H14O. It is a kind of colourless liquid, and usually used as intermediates of liquid crystals. What's more, it is it is an inhibitor of the enzyme carbonyl reductase, and it is also used as a tool in the study of various photochemical processes.

The physical properties of 1-Pentanone, 1-phenyl- are as following: (1)ACD/LogP: 3.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.26; (4)ACD/LogD (pH 7.4): 3.26; (5)ACD/BCF (pH 5.5): 176.54; (6)ACD/BCF (pH 7.4): 176.54; (7)ACD/KOC (pH 5.5): 1412.18; (8)ACD/KOC (pH 7.4): 1412.18; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.5; (14)Molar Refractivity: 50.17 cm3; (15)Molar Volume: 170.4 cm3; (16)Polarizability: 19.89×10-24cm3; (17)Surface Tension: 34 dyne/cm; (18)Density: 0.951 g/cm3; (19)Flash Point: 99.7 °C; (20)Enthalpy of Vaporization: 48.57 kJ/mol; (21)Boiling Point: 248.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0242 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; Do not breathe dust and then try to avoid contacting with skin and eyes.

You can still convert the following datas into molecular structure:
(1)SMILES:O=C(c1ccccc1)CCCC
(2)InChI: InChI=1/C11H14O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3
(3)InChIKey: XKGLSKVNOSHTAD-UHFFFAOYAK

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