Products Categories
CAS No.: | 110926-01-7 |
---|---|
Name: | OXAZOL-4-AMINE |
Molecular Structure: | |
Formula: | C3H4N2O |
Molecular Weight: | 84.0776 |
Synonyms: | 1,3-oxazol-4-amine; |
Density: | 1.241 g/cm3 |
Boiling Point: | 202.896 °C at 760 mmHg |
Flash Point: | 76.509 °C |
PSA: | 52.05000 |
LogP: | 0.83800 |
The 4-Oxazolamine has CAS registry number 110926-01-7. Its molecular formula is C3H4N2O and molecular weight is 84.0776. What's more, its systematic name is 1,3-Oxazol-4-amine.
Physical properties about the 4-Oxazolamine are: (1)ACD/LogP: -0.19; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 6; (6)ACD/KOC (pH 7.4): 6; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 52.05 Å2; (11)Index of Refraction: 1.529; (12)Molar Refractivity: 20.88 cm3; (13)Molar Volume: 67.732 cm3; (14)Surface Tension: 51.262 dyne/cm; (15)Density: 1.241 g/cm3; (16)Flash Point: 76.509 °C; (17)Enthalpy of Vaporization: 43.912 kJ/mol; (18)Boiling Point: 202.896 °C at 760 mmHg; (19)Vapour Pressure: 0.285 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Nc1cocn1
(2) InChI: InChI=1/C3H4N2O/c4-3-1-6-2-5-3/h1-2H,4H2
(3) InChIKey: NXWFZLSDGBWCMN-UHFFFAOYAN