1-Dodecanone, 1-phenyl- supplier

Name
LAUROPHENONE
EINECS 216-818-8
CAS No. 1674-38-0
Article Data39
CAS DataBase
Density 0.91 g/cm³
Solubility
Melting Point 44-47 °C
Formula C₁₈H₂₈O
Boiling Point 214-215 °C (16 mmHg)
Molecular Weight 260.42
Flash Point 137.2 °C
Transport Information
Appearance white to beige crystalline mass or powder
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Laurophenone(6CI,7CI,8CI);1-Phenyl-1-dodecanone;Dodecanophenone;NSC 4903;Phenyln-undecyl ketone;Phenyl undecyl ketone;Undecyl phenyl ketone;n-Undecylphenyl ketone;
PSA 17.07000
LogP 5.79020

1-Dodecanone, 1-phenyl- Specification

The 1-Dodecanone, 1-phenyl-, with CAS registry number 1674-38-0, has the systematic name of 1-phenyldodecan-1-one. Besides this, it is also called Laurophenone. This chemical is a kind of white to beige crystalline mass or powder. When use this chemical, please avoid contact with skin and eyes. What's more, its EINECS is 216-818-8.

Physical properties of 1-Dodecanone, 1-phenyl-: (1)ACD/LogP: 6.98; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.98; (4)ACD/LogD (pH 7.4): 6.98; (5)ACD/BCF (pH 5.5): 118471.43; (6)ACD/BCF (pH 7.4): 118471.43; (7)ACD/KOC (pH 5.5): 149028.97; (8)ACD/KOC (pH 7.4): 149028.97; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.489; (14)Molar Refractivity: 82.6 cm³; (15)Molar Volume: 286 cm³; (16)Polarizability: 32.74×10^-24cm³; (17)Surface Tension: 33.9 dyne/cm; (18)Density: 0.91 g/cm³; (19)Flash Point: 137.2 °C; (20)Enthalpy of Vaporization: 60.5 kJ/mol; (21)Boiling Point: 359.4 °C at 760 mmHg; (22)Vapour Pressure: 2.39E-05 mmHg at 25°C.

Uses of 1-Dodecanone, 1-phenyl-: it can be used to produce 2-bromo-1-phenyl-dodecan-1-one. This reaction will need reagent Br₂ and solvent acetic acid. The yield is about 85%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)CCCCCCCCCCC
(2)InChI: InChI=1/C18H28O/c1-2-3-4-5-6-7-8-9-13-16-18(19)17-14-11-10-12-15-17/h10-12,14-15H,2-9,13,16H2,1H3
(3)InChIKey: DJNJZIFFCJTUDS-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C18H28O/c1-2-3-4-5-6-7-8-9-13-16-18(19)17-14-11-10-12-15-17/h10-12,14-15H,2-9,13,16H2,1H3
(5)Std. InChIKey: DJNJZIFFCJTUDS-UHFFFAOYSA-N

Product Name

LAUROPHENONE

1-Dodecanone, 1-phenyl- Specification

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