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4-Oxazolamine

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Name

4-Oxazolamine

EINECS N/A
CAS No. 110926-01-7 Density 1.241 g/cm3
PSA 52.05000 LogP 0.83800
Solubility N/A Melting Point N/A
Formula C3H4N2O Boiling Point 202.896 °C at 760 mmHg
Molecular Weight 84.0776 Flash Point 76.509 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 110926-01-7 (OXAZOL-4-AMINE) Hazard Symbols N/A
Synonyms

1,3-oxazol-4-amine;

 

4-Oxazolamine Specification

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

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