2H-1,4-Benzoxazin-3(4H)-one,6-amino-4-methyl- supplier

Name
6-AMINO-4-METHYL-2H-1,4-BENZOXAZIN-3(4H)-ONE
EINECS
CAS No. 103361-43-9
Article Data6
CAS DataBase
Density 1.299 g/cm³
Solubility
Melting Point 152-153.5 °C
Formula C₉H₁₀N₂O₂
Boiling Point 486.2 °C at 760 mmHg
Molecular Weight 178.19
Flash Point 247.9 °C
Transport Information
Appearance
Safety
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms 6-Amino-4-methyl-2h-1,4-benzoxazin-3(4h)-one;6-Amino-4-methyl-4h-benzo[1,4]oxazin-3-one;
PSA 55.56000
LogP 1.27020

2H-1,4-Benzoxazin-3(4H)-one,6-amino-4-methyl- Specification

The CAS register number of 2H-1,4-Benzoxazin-3(4H)-one,6-amino-4-methyl- is 103361-43-9. It also can be called as 6-Amino-4-methyl-4h-benzo[1,4]oxazin-3-one and the IUPAC name about this chemical is 6-amino-4-methyl-1,4-benzoxazin-3-one. The molecular formula about this chemical is C₉H₁₀N₂O₂ and the molecular weight is 178.19. This chemical is irritant and it may cause inflammation to the skin or other mucous membranes.

Physical properties about 2H-1,4-Benzoxazin-3(4H)-one,6-amino-4-methyl- are: (1)ACD/LogP: -0.13; (2)ACD/LogD (pH 5.5): -0.16; (3)ACD/LogD (pH 7.4): -0.13; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 19.06; (7)ACD/KOC (pH 7.4): 20.2; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 32.78 Å²; (12)Index of Refraction: 1.618; (13)Molar Refractivity: 48.06 cm³; (14)Molar Volume: 137.1 cm³; (15)Polarizability: 19.05x10^-24cm³; (16)Surface Tension: 54.3 dyne/cm; (17)Density: 1.299 g/cm³; (18)Flash Point: 247.9 °C; (19)Enthalpy of Vaporization: 75.19 kJ/mol; (20)Boiling Point: 486.2 °C at 760 mmHg; (21)Vapour Pressure: 1.32E-09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1N(c2c(OC1)ccc(N)c2)C
(2)InChI: InChI=1/C9H10N2O2/c1-11-7-4-6(10)2-3-8(7)13-5-9(11)12/h2-4H,5,10H2,1H3
(3)InChIKey: QXLKSGOSLHFMIU-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C9H10N2O2/c1-11-7-4-6(10)2-3-8(7)13-5-9(11)12/h2-4H,5,10H2,1H3
(5)Std. InChIKey: QXLKSGOSLHFMIU-UHFFFAOYSA-N

Product Name

6-AMINO-4-METHYL-2H-1,4-BENZOXAZIN-3(4H)-ONE

2H-1,4-Benzoxazin-3(4H)-one,6-amino-4-methyl- Specification

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