(E)-2-Acetoxy-2'-bromo-5'-chlorostilbene supplier

Name
(E)-2-Acetoxy-2’-bromo-5’-chlorostilbene
EINECS
CAS No. 1000890-01-6
Article Data2
CAS DataBase
Density 1.475 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₂BrClO₂
Boiling Point 440.519 °C at 760 mmHg
Molecular Weight 351.627
Flash Point 220.218 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms [2-[(E)-2-(2-Bromo-5-chloro-phenyl)vinyl]phenyl] acetate;
PSA 26.30000
LogP 5.19820

(E)-2-Acetoxy-2'-bromo-5'-chlorostilbene Specification

The (E)-2-Acetoxy-2'-bromo-5'-chlorostilbene has the CAS registry number 1000890-01-6. This chemical's molecular formula is C₁₆H₁₂BrClO₂ and molecular weight is 351.62. What's more, its systematic name is [2-[(E)-2-(2-Bromo-5-chloro-phenyl)vinyl]phenyl] acetate.

Physical properties of (E)-2-Acetoxy-2'-bromo-5'-chlorostilbene are: (1)ACD/LogP: 4.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.829; (4)ACD/LogD (pH 7.4): 4.829; (5)ACD/BCF (pH 5.5): 2756.633; (6)ACD/BCF (pH 7.4): 2756.633; (7)ACD/KOC (pH 5.5): 10097.609; (8)ACD/KOC (pH 7.4): 10097.609; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.656; (14)Molar Refractivity: 87.573 cm³; (15)Molar Volume: 238.405 cm³; (16)Polarizability: 34.717×10^-24cm³; (17)Surface Tension: 48.715 dyne/cm; (18)Density: 1.475 g/cm³; (19)Flash Point: 220.218 °C; (20)Enthalpy of Vaporization: 69.766 kJ/mol; (21)Boiling Point: 440.519 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)Oc1ccccc1/C=C/c2cc(ccc2Br)Cl
(2)InChI: InChI=1/C16H12BrClO2/c1-11(19)20-16-5-3-2-4-12(16)6-7-13-10-14(18)8-9-15(13)17/h2-10H,1H3/b7-6+
(3)InChIKey: HLFSLKCOGBEHAK-VOTSOKGWSA-N

Product Name

(E)-2-Acetoxy-2’-bromo-5’-chlorostilbene

(E)-2-Acetoxy-2'-bromo-5'-chlorostilbene Specification

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