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Basic Information
CAS No.: 56346-41-9
Name: 7-Fluoro-3,4-dihydro-2H-benzo[1,4]oxazine
Molecular Structure:
Molecular Structure of 56346-41-9 (7-Fluoro-3,4-dihydro-2H-benzo[1,4]oxazine)
Formula: C8H8FNO
Molecular Weight: 153.156
Synonyms: 3,4-Dihydro-7-fluoro-2H-1,4-benzoxazine;7-Fluoro-3,4-dihydro-2H-1,4-benzoxazine;7-Fluoro-3,4-dihydro-2H-benzo[b][1,4]oxazine;
Density: 1.201 g/cm3
Boiling Point: 243.664 °C at 760 mmHg
Flash Point: 101.165 °C
PSA: 21.26000
LogP: 1.76800
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Specification

The 2H-1,4-Benzoxazine, 7-fluoro-3,4-dihydro-, with the CAS registry number 56346-41-9, is also known as 3,4-Dihydro-7-fluoro-2H-1,4-benzoxazine. This chemical's molecular formula is C8H8FNO and molecular weight is 153.15. What's more, its systematic name is 7-Fluoro-3,4-dihydro-2H-1,4-benzoxazine.

Physical properties of 2H-1,4-Benzoxazine, 7-fluoro-3,4-dihydro- are: (1)ACD/LogP: 1.51; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.46; (4)ACD/LogD (pH 7.4): 1.505; (5)ACD/BCF (pH 5.5): 7.393; (6)ACD/BCF (pH 7.4): 8.193; (7)ACD/KOC (pH 5.5): 141.472; (8)ACD/KOC (pH 7.4): 156.78; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 21.26 Å2; (13)Index of Refraction: 1.52; (14)Molar Refractivity: 38.763 cm3; (15)Molar Volume: 127.549 cm3; (16)Polarizability: 15.367×10-24 cm3; (17)Surface Tension: 38.64 dyne/cm; (18)Density: 1.201 g/cm3; (19)Flash Point: 101.165 °C; (20)Enthalpy of Vaporization: 48.069 kJ/mol; (21)Boiling Point: 243.664 °C at 760 mmHg; (22)Vapour Pressure: 0.032 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(cc1F)OCCN2
(2)InChI: InChI=1S/C8H8FNO/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-2,5,10H,3-4H2
(3)InChIKey: VRBQMPCMLZNPSK-UHFFFAOYSA-N