4-Chloro-3-methyl-5-isoxazolamine supplier

Name
5-AMINO-4-CHLORO-3-METHYLISOXAZOLE
EINECS
CAS No. 166964-09-6
Article Data14
CAS DataBase
Density 1.381 g/cm³
Solubility
Melting Point
Formula C₄H₅ClN₂O
Boiling Point 245.105 °C at 760 mmHg
Molecular Weight 132.55
Flash Point 102.036 °C
Transport Information
Appearance
Safety
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms 5-Amino-4-chloro-3-methylisoxazole;4-Chloro-3-methyl-5-aminoisoxazole;
PSA 52.05000
LogP 1.79980

4-Chloro-3-methyl-5-isoxazolamine Specification

This chemical is called 4-Chloro-3-methyl-1,2-oxazol-5-amine. With the molecular formula of C₄H₅ClN₂O, its molecular weight is 132.55. The CAS registry number of this chemical is 166964-09-6.

Other characteristics of the 4-Chloro-3-methyl-1,2-oxazol-5-amine can be summarised as followings: (1)ACD/LogP: 1.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 80; (8)ACD/KOC (pH 7.4): 80; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 52.05 Å²; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 30.6 cm³; (15)Molar Volume: 95.958 cm³; (16)Polarizability: 12.131×10^-24cm³; (17)Surface Tension: 49.673 dyne/cm; (18)Density: 1.381 g/cm³; (19)Flash Point: 102.036 °C; (20)Enthalpy of Vaporization: 48.218 kJ/mol; (21)Boiling Point: 245.105 °C at 760 mmHg; (22)Vapour Pressure: 0.029 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Clc1c(onc1C)N
2.InChI: InChI=1/C4H5ClN2O/c1-2-3(5)4(6)8-7-2/h6H2,1H3
3.InChIKey: QMZMMMMDQVQCHL-UHFFFAOYAA

Product Name

5-AMINO-4-CHLORO-3-METHYLISOXAZOLE

4-Chloro-3-methyl-5-isoxazolamine Specification

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