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153138-00-2

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Basic Information
CAS No.: 153138-00-2
Name: 2-Methyloxazol-4-amine
Molecular Structure:
Molecular Structure of 153138-00-2 (2-Methyloxazol-4-amine)
Formula: C4H6N2O
Molecular Weight: 98.1044
Synonyms: 4-OXAZOLAMINE,2-METHYL;2-Methyloxazol-4-amine;
Density: 1.168 g/cm3
Melting Point: 78-79 °C
Boiling Point: 203.24 °C at 760 mmHg
Flash Point: 76.717 °C
PSA: 52.05000
LogP: 1.14640
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Specification

The 2-Methyloxazol-4-amine, with the CAS registry number of 153138-00-2, is also known as 2-Oxazolamine, 4-methyl-. Its molecular formula is C4H6N2O and molecular weight is 98.1044. What's more, its systematic name is 4-Methyl-1,3-oxazol-2-amine.

Physical properties about the 2-Methyloxazol-4-amine are: (1)ACD/LogP: 0.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 9.182; (7)ACD/KOC (pH 7.4): 26.709; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 0; (11)Polar Surface Area: 52.05 Å2; (12)Index of Refraction: 1.524; (13)Molar Refractivity: 25.705 cm3; (14)Molar Volume: 84.007 cm3; (15)Surface Tension: 46.085 dyne/cm; (16)Density: 1.168 g/cm3; (17)Flash Point: 76.717 °C; (18)Enthalpy of Vaporization: 43.946 kJ/mol; (19)Boiling Point: 203.24 °C at 760 mmHg; (20)Vapour Pressure: 0.28 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cc1coc(n1)N
(2) InChI: InChI=1/C4H6N2O/c1-3-2-7-4(5)6-3/h2H,1H3,(H2,5,6)
(3) InChIKey: VCZJVXLWQTXSPQ-UHFFFAOYAS