1-Phenylbutan-2-one supplier | CasNO.41903-43-9

Name
1-Phenylbutan-2-one
EINECS
CAS No. 41903-43-9
Density 0.972 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₂O
Boiling Point 228.1 °C at 760 mmHg
Molecular Weight 148.20
Flash Point 90.6 °C
Transport Information
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Risk Codes
Molecular Structure
Hazard Symbols
Synonyms
PSA
LogP

1-Phenylbutan-2-one Specification

This chemical is called 1-Phenylbutan-2-one, and it can also be named as 2-butanone, 1-phenyl-. With the molecular formula of C₁₀H₁₂O, its molecular weight is 148.20. The CAS registry number of this chemical is 41903-43-9.

Other characteristics of the 1-Phenylbutan-2-one can be summarised as followings: (1)ACD/LogP: 1.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.97; (4)ACD/LogD (pH 7.4): 1.97; (5)ACD/BCF (pH 5.5): 18.51; (6)ACD/BCF (pH 7.4): 18.51; (7)ACD/KOC (pH 5.5): 281.11; (8)ACD/KOC (pH 7.4): 281.11; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.503; (14)Molar Refractivity: 45.09 cm³; (15)Molar Volume: 152.3 cm³; (16)Polarizability: 17.87×10^-24cm³; (17)Surface Tension: 34.1 dyne/cm; (18)Density: 0.972 g/cm³; (19)Flash Point: 90.6 °C; (20)Enthalpy of Vaporization: 46.46 kJ/mol; (21)Boiling Point: 228.1 °C at 760 mmHg; (22)Vapour Pressure: 0.075 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(Cc1ccccc1)CC
2.InChI: InChI=1/C10H12O/c1-2-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
3.InChIKey: GKDLTXYXODKDEA-UHFFFAOYAG

Product Name

1-Phenylbutan-2-one

1-Phenylbutan-2-one Specification

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