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704879-74-3

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Basic Information
CAS No.: 704879-74-3
Name: 2H-1,4-Benzoxazin-8-amine,3,4-dihydro-(9CI)
Molecular Structure:
Molecular Structure of 704879-74-3 (2H-1,4-Benzoxazin-8-amine,3,4-dihydro-(9CI))
Formula: C8H10N2O
Molecular Weight: 150.18
Synonyms: 2H-1,4-Benzoxazin-8-amine,3,4-dihydro-(9CI);
Density: 1.196 g/cm3
Boiling Point: 317.48 °C at 760 mmHg
Flash Point: 145.807 °C
PSA: 47.28000
LogP: 1.79230
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Specification

The CAS register number of 2H-1,4-Benzoxazin-8-amine,3,4-dihydro- is 704879-74-3. The systematic name about this chemical is 3,4-dihydro-2H-1,4-benzoxazin-8-amine. The molecular formula about this chemical is C8H10N2O and the molecular weight is 150.18. It belongs to the following product category which includes Amineprimary.

Physical properties about 2H-1,4-Benzoxazin-8-amine,3,4-dihydro- are: (1)ACD/LogP: 0.20; (2)ACD/LogD (pH 5.5): 0.013; (3)ACD/LogD (pH 7.4): 0.198; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 19.886; (7)ACD/KOC (pH 7.4): 30.42; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 47.28 Å2; (12)Index of Refraction: 1.601; (13)Molar Refractivity: 43.005 cm3; (14)Molar Volume: 125.619 cm3; (15)Polarizability: 17.048x10-24cm3; (16)Surface Tension: 51.621 dyne/cm; (17)Density: 1.196 g/cm3; (18)Flash Point: 145.807 °C; (19)Enthalpy of Vaporization: 55.89 kJ/mol; (20)Boiling Point: 317.48 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(c2c(c1)NCCO2)N
(2)InChI: InChI=1/C8H10N2O/c9-6-2-1-3-7-8(6)11-5-4-10-7/h1-3,10H,4-5,9H2
(3)InChIKey: IUBFVHKXWXHRJS-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C8H10N2O/c9-6-2-1-3-7-8(6)11-5-4-10-7/h1-3,10H,4-5,9H2
(5)Std. InChIKey: IUBFVHKXWXHRJS-UHFFFAOYSA-N