1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline supplier

Name
1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline
EINECS
CAS No. 20323-75-5
Article Data5
CAS DataBase
Density 1.184 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₃NO₃
Boiling Point 403.9 °C at 760 mmHg
Molecular Weight 219.24
Flash Point 198.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline
PSA 40.46000
LogP 1.55570

1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline Specification

The 1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline, with the CAS registry number 20323-75-5. This chemical's molecular formula is C₁₂H₁₃NO₃and molecular weight is 219.2365. What's more, Its systematic name is called 6,7-Dimethoxy-2-methylisoquinolin-1(2H)-one.

Physical properties about 1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline are: (1)ACD/LogP: 1.38; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.38; (4)ACD/LogD (pH 7.4): 1.38; (5)ACD/BCF (pH 5.5): 6.53; (6)ACD/BCF (pH 7.4): 6.53; (7)ACD/KOC (pH 5.5): 133.39; (8)ACD/KOC (pH 7.4): 133.39; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 38.77 Å²; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 59.79 cm³; (15)Molar Volume: 185.1 cm³; (16)Polarizability: 23.7×10^-24cm³; (17)Surface Tension: 41.1 dyne/cm; (18)Density: 1.184 g/cm³; (19)Flash Point: 198.1 °C; (20)Enthalpy of Vaporization: 65.53 kJ/mol; (21)Boiling Point: 403.9 °C at 760 mmHg; (22)Vapour Pressure: 9.84E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C1c2cc(OC)c(OC)cc2\C=C/N1C
(2) InChI: InChI=1/C12H13NO3/c1-13-5-4-8-6-10(15-2)11(16-3)7-9(8)12(13)14/h4-7H,1-3H3
(3) InChIKey: HCHLTWGUUUDWFP-UHFFFAOYAI

Product Name

1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline

1-Oxo-2-methyl-6,7-dimethoxy-1,2-dihydroisoquinoline Specification

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