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CAS No.: | 6343-72-2 |
---|---|
Name: | 6-BROMO-2-NAPHTHYL ACETATE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C12H9BrO2 |
Molecular Weight: | 265.106 |
Synonyms: | 2-Naphthalenol,6-bromo-, acetate (9CI);2-Naphthol, 6-bromo-, acetate (6CI,8CI);2-Acetoxy-6-bromonaphthalene;6-Bromo-2-naphthyl acetate;NSC 49741; |
EINECS: | 228-740-1 |
Density: | 1.494 g/cm3 |
Boiling Point: | 363.1 °C at 760 mmHg |
Flash Point: | 173.4 °C |
PSA: | 26.30000 |
LogP: | 3.52760 |
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The CAS register number of 2-Naphthalenol,6-bromo-, 2-acetate is 6343-72-2. It also can be called as 2-Acetoxy-6-bromonaphthalene and the systematic name about this chemical is 6-bromonaphthalen-2-yl acetate. The molecular formula about this chemical is C12H9BrO2 and the molecular weight is 265.1.
Physical properties about 2-Naphthalenol,6-bromo-, 2-acetate are: (1)ACD/LogP: 3.56; (2)ACD/LogD (pH 5.5): 3.56; (3)ACD/LogD (pH 7.4): 3.56; (4)ACD/BCF (pH 5.5): 297.73; (5)ACD/BCF (pH 7.4): 297.73; (6)ACD/KOC (pH 5.5): 2052.92; (7)ACD/KOC (pH 7.4): 2052.92; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 26.3 Å2; (11)Index of Refraction: 1.63; (12)Molar Refractivity: 63.12 cm3; (13)Molar Volume: 177.3 cm3; (14)Polarizability: 25.02x10-24cm3; (15)Surface Tension: 46.4 dyne/cm; (16)Density: 1.494 g/cm3; (17)Flash Point: 173.4 °C; (18)Enthalpy of Vaporization: 60.91 kJ/mol; (19)Boiling Point: 363.1 °C at 760 mmHg; (20)Vapour Pressure: 1.85E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Oc1ccc2c(c1)ccc(Br)c2)C
(2)InChI: InChI=1/C12H9BrO2/c1-8(14)15-12-5-3-9-6-11(13)4-2-10(9)7-12/h2-7H,1H3
(3)InChIKey: IXQUUGRFWVXBEZ-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C12H9BrO2/c1-8(14)15-12-5-3-9-6-11(13)4-2-10(9)7-12/h2-7H,1H3
(5)Std. InChIKey: IXQUUGRFWVXBEZ-UHFFFAOYSA-N