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5,6-Dimethoxy-1-indanone oxime

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Name

5,6-Dimethoxy-1-indanone oxime

EINECS N/A
CAS No. 15547-61-2 Density 1.249 g/cm3
PSA N/A LogP N/A
Solubility N/A Melting Point N/A
Formula C11H13NO3 Boiling Point 371.76 °C at 760 mmHg
Molecular Weight 207.229 Flash Point 178.634 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 15547-61-2 (5,6-Dimethoxy-1-indanone oxime 98%) Hazard Symbols N/A
Synonyms

5,6-Dimethoxyindan-1-one oxime;5,6-Dimethoxy-2,3-dihydroinden-1-one oxime;

 

5,6-Dimethoxy-1-indanone oxime Specification

This chemical has the systematic name 5,6-Dimethoxy-1-indanone oxime. With the molecular formula of C11H13NO3, its molecular weight is 207.22. The CAS registry number of this chemical is 15547-61-2.

Other characteristics of the 5,6-Dimethoxy-1-indanone oxime can be summarised as followings: (1)ACD/LogP: 2.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.691; (4)ACD/LogD (pH 7.4): 2.691; (5)ACD/BCF (pH 5.5): 65.288; (6)ACD/BCF (pH 7.4): 65.284; (7)ACD/KOC (pH 5.5): 692.9; (8)ACD/KOC (pH 7.4): 692.855; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 51.05 Å2; (13)Index of Refraction: 1.57; (14)Molar Refractivity: 54.453 cm3; (15)Molar Volume: 165.893 cm3; (16)Polarizability: 21.587×10-24cm3; (17)Surface Tension: 40.382 dyne/cm; (18)Density: 1.249 g/cm3; (19)Flash Point: 178.634 °C; (20)Enthalpy of Vaporization: 65.284 kJ/mol; (21)Boiling Point: 371.76 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: COc1cc2c(cc1OC)/C(=N/O)/CC2
2.InChI: InChI=1/C11H13NO3/c1-14-10-5-7-3-4-9(12-13)8(7)6-11(10)15-2/h5-6,13H,3-4H2,1-2H3/b12-9+
3.InChIKey: HSOBEIMRWGKGGG-FMIVXFBMBU

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