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1002726-62-6

Basic Information
CAS No.: 1002726-62-6
Name: 2H-Pyrido[3,2-b]-1,4-oxazin-3(4H)-one, 6-amino-2,2-dimethyl-
Molecular Structure:
Molecular Structure of 1002726-62-6 (2H-Pyrido[3,2-b]-1,4-oxazin-3(4H)-one, 6-amino-2,2-dimethyl-)
Formula: C9H11N3O2
Molecular Weight: 193.20
Synonyms: 6-AMINO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
EINECS:
Density: 1.257 g/cm3
Melting Point:
Boiling Point: 420.336 °C at 760 mmHg
Flash Point: 208.012 °C
Solubility:
Appearance:
Hazard Symbols:
Risk Codes:
Safety:
Transport Information:
PSA: 77.24000
LogP: 1.49250
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  • CAS:1002726-62-6 C9H11N3O2 6-AMINO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE

  • Casno:

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  • 6-Amino-2,2-Dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

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  • 6-AMINO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
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    1002726-62-6

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  • 6-Amino-2,2-dimethyl-2H-pyrido[3,2-b] [1,4]oxazin-3[4H]-one

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    1002726-62-6

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  • 6-AMINO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE

  • Casno:

    1002726-62-6

    6-AMINO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE

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Specification

The 6-Amino-2,2-Dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one, with the CAS registry number 1002726-62-6, is also known as 2H-Pyrido[3,2-b]-1,4-oxazin-3(4H)-one, 6-amino-2,2-dimethyl-. This chemical's molecular formula is C9H11N3O2 and molecular weight is 193.20. What's more, its systematic name is 6-Amino-2,2-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one. 

Physical properties of 6-Amino-2,2-Dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one are: (1)ACD/LogP: 1.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.25; (4)ACD/LogD (pH 7.4): 1.25; (5)ACD/BCF (pH 5.5): 5.23; (6)ACD/BCF (pH 7.4): 5.25; (7)ACD/KOC (pH 5.5): 113.70; (8)ACD/KOC (pH 7.4): 113.97; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 77.24 Å2; (13)Index of Refraction: 1.571; (14)Molar Refractivity: 50.548 cm3; (15)Molar Volume: 153.755 cm3; (16)Polarizability: 20.039×10-24cm3; (17)Surface Tension: 48.7 dyne/cm; (18)Density: 1.257 g/cm3; (19)Flash Point: 208.012 °C; (20)Enthalpy of Vaporization: 67.418 kJ/mol; (21)Boiling Point: 420.336 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC1(C(=O)Nc2c(ccc(n2)N)O1)C
(2)Std. InChI: InChI=1S/C9H11N3O2/c1-9(2)8(13)12-7-5(14-9)3-4-6(10)11-7/h3-4H,1-2H3,(H3,10,11,12,13)
(3)Std. InChIKey: HSYOWUOUDXDSMC-UHFFFAOYSA-N