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Name |
Undecanoyl chloride,11-bromo- |
EINECS | 240-082-7 |
CAS No. | 15949-84-5 | Density | 1.223 g/cm3 |
PSA | 17.07000 | LogP | 4.65760 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H20BrClO | Boiling Point | 315.1 °C at 760 mmHg |
Molecular Weight | 283.636 | Flash Point | 144.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
11-Bromoundecanoicacid chloride;11-Bromoundecanoyl chloride; |
Article Data | 91 |
The Undecanoyl chloride,11-bromo- is an organic compound with the formula C11H20BrClO. The IUPAC name of this chemical is 11-Bromoundecanoyl chloride. With the CAS registry number 15949-84-5, it is also named as 11-Bromoundecanoic acid chloride. Besides, its molecular weight is 283.6329.
Physical properties about Undecanoyl chloride,11-bromo- are: (1)ACD/LogP: 5.10; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.1; (4)ACD/LogD (pH 7.4): 5.1; (5)ACD/BCF (pH 5.5): 4430.78; (6)ACD/BCF (pH 7.4): 4430.78; (7)ACD/KOC (pH 5.5): 14182.19; (8)ACD/KOC (pH 7.4): 14182.19; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 10; (11)Polar Surface Area: 17.07 Å2; (12)Index of Refraction: 1.478; (13)Molar Refractivity: 65.62 cm3; (14)Molar Volume: 231.7 cm3; (15)Polarizability: 26.01×10-24 cm3; (16)Surface Tension: 35.4 dyne/cm; (17)Density: 1.223 g/cm3; (18)Flash Point: 144.4 °C; (19)Enthalpy of Vaporization: 55.63 kJ/mol; (20)Boiling Point: 315.1 °C at 760 mmHg; (21)Vapour Pressure: 0.000446 mmHg at 25 °C.
Preparation: this chemical can be prepared by 11-Bromo-undecanoic acid. This reaction will need reagent SOCl2, and solvent Toluene. The reaction time is 24 hours with reaction temperature of 20 °C.
Uses of Undecanoyl chloride,11-bromo-: it can be used to produce 11-Brom-undecansaeure-(1)-dimethylamid. It will need solvent Benzene with reaction time of 3 hours. The yield is about 77%.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C11H20BrClO/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10H2
(2)InChIKey: QWHOIFRYXGBPRO-UHFFFAOYAM
(3)Std. InChI: InChI=1S/C11H20BrClO/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10H2
(4)Std. InChIKey: QWHOIFRYXGBPRO-UHFFFAOYSA-N