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6-Bromo-1-tetralone

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Name

6-Bromo-1-tetralone

EINECS N/A
CAS No. 66361-67-9 Density 1.511 g/cm3
PSA 17.07000 LogP 2.96810
Solubility N/A Melting Point 40-42℃
Formula C10H9BrO Boiling Point 323.109 °C at 760 mmHg
Molecular Weight 225.085 Flash Point 111.44 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 66361-67-9 (6-BROMO-TETRAL-1-ON) Hazard Symbols N/A
Synonyms

6-Bromo-1-tetralone;6-Bromotetral-1-one;

Article Data 30

6-Bromo-1-tetralone Specification

The 1(2H)-Naphthalenone, 6-bromo-3,4-dihydro- is an organic compound with the formula C10H9BrO. The IUPAC name of this chemical is 6-bromo-3,4-dihydro-2H-naphthalen-1-one. With the CAS registry number 66361-67-9, it is also named as 6-Bromo-1-tetralone.

Physical properties about 1(2H)-Naphthalenone, 6-bromo-3,4-dihydro- are: (1)ACD/LogP: 2.35; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 36; (5)ACD/BCF (pH 7.4): 36; (6)ACD/KOC (pH 5.5): 450; (7)ACD/KOC (pH 7.4): 450; (8)#H bond acceptors: 1; (9)Polar Surface Area: 17.07 Å2; (10)Index of Refraction: 1.599; (11)Molar Refractivity: 50.86 cm3; (12)Molar Volume: 148.945 cm3; (13)Polarizability: 20.162×10-24cm3; (14)Surface Tension: 46.441 dyne/cm; (15)Density: 1.511 g/cm3; (16)Flash Point: 111.44 °C; (17)Enthalpy of Vaporization: 56.502 kJ/mol; (18)Boiling Point: 323.109 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(cc1Br)CCCC2=O
(2)InChI: InChI=1/C10H9BrO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3H2
(3)InChIKey: OSDHOOBPMBLALZ-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C10H9BrO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3H2
(5)Std. InChIKey: OSDHOOBPMBLALZ-UHFFFAOYSA-N

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