7-Methoxy-3,4-dihydro-2H-benzo[1,4]oxazine supplier

Name
7-Methoxy-3,4-dihydro-2H-benzo[1,4]oxazine
EINECS
CAS No. 93735-22-9
Article Data8
CAS DataBase
Density 1.121 g/cm³
Solubility
Melting Point
Formula C₉H₁₁NO₂
Boiling Point 295.512 °C at 760 mmHg
Molecular Weight 165.192
Flash Point 111.892 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 7-Methoxy-3,4-dihydro-2H-1,4-benzoxazine;
PSA 30.49000
LogP 1.63750

7-Methoxy-3,4-dihydro-2H-benzo[1,4]oxazine Specification

The 7-Methoxy-3,4-dihydro-2H-benzo[1,4]oxazine, with the CAS registry number 93735-22-9, is also known as 2H-1,4-Benzoxazine,3,4-dihydro-7-methoxy-. This chemical's molecular formula is C₉H₁₁NO₂ and molecular weight is 165.19. What's more, its systematic name is 7-Methoxy-3,4-dihydro-2H-1,4-benzoxazine.

Physical properties of 7-Methoxy-3,4-dihydro-2H-benzo[1,4]oxazine are: (1)ACD/LogP: 1.335; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.10; (4)ACD/LogD (pH 7.4): 1.33; (5)ACD/BCF (pH 5.5): 3.56; (6)ACD/BCF (pH 7.4): 6.04; (7)ACD/KOC (pH 5.5): 74.08 ; (8)ACD/KOC (pH 7.4): 125.70; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 30.49 Å²; (13)Index of Refraction: 1.529; (14)Molar Refractivity: 45.447 cm³; (15)Molar Volume: 147.342 cm³; (16)Polarizability: 18.017×10^-24cm³; (17)Surface Tension: 38.7 dyne/cm; (18)Density: 1.121 g/cm³; (19)Flash Point: 111.892 °C; (20)Enthalpy of Vaporization: 53.523 kJ/mol; (21)Boiling Point: 295.512 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1ccc2NCCOc2c1
(2)Std. InChI: InChI=1S/C9H11NO2/c1-11-7-2-3-8-9(6-7)12-5-4-10-8/h2-3,6,10H,4-5H2,1H3
(3)Std. InChIKey: SHPHWZPKRWHBKE-UHFFFAOYSA-N

Product Name

7-Methoxy-3,4-dihydro-2H-benzo[1,4]oxazine

7-Methoxy-3,4-dihydro-2H-benzo[1,4]oxazine Specification

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