4-(5-Chloromethyl-1,2,4-oxadiazol-3-yl)aniline supplier

Name
4-(5-CHLOROMETHYL-[1,2,4]OXADIAZOL-3-YL)-ANILINE
EINECS
CAS No. 6674-17-5
Density 1.361 g/cm³
Solubility
Melting Point
Formula C₉H₈ClN₃O
Boiling Point 390.4 °C at 760 mmHg
Molecular Weight 209.635
Flash Point 189.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms trimethyl-[4-tris(4-trimethylsilylphenyl)silylphenyl]silane;4-(5-Chloromethyl-[1,2,4]oxadiazol-3-yl)-aniline;
PSA 64.94000
LogP 2.63880

4-(5-Chloromethyl-1,2,4-oxadiazol-3-yl)aniline Specification

This chemical is called 4-(5-Chloromethyl-1,2,4-oxadiazol-3-yl)aniline, and it can also be named as Benzenamine, 4-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-. With the molecular formula of C₉H₈ClN₃O, its molecular weight is 209.63. The CAS registry number of this chemical is 6674-17-5.

Other characteristics of the 4-(5-Chloromethyl-1,2,4-oxadiazol-3-yl)aniline can be summarised as followings: (1)ACD/LogP: 1.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.75; (4)ACD/LogD (pH 7.4): 1.75; (5)#H bond acceptors: 4; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 64.94 Å²; (9)Index of Refraction: 1.609; (10)Molar Refractivity: 53.32 cm³; (11)Molar Volume: 153.9 cm³; (12)Polarizability: 21.14×10^-24cm³; (13)Surface Tension: 57.5 dyne/cm; (14)Density: 1.361 g/cm³; (15)Flash Point: 189.9 °C; (16)Enthalpy of Vaporization: 63.99 kJ/mol; (17)Boiling Point: 390.4 °C at 760 mmHg; (18)Vapour Pressure: 2.65E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Nc1ccc(cc1)c2nc(CCl)on2
2.InChI: InChI=1/C9H8ClN3O/c10-5-8-12-9(13-14-8)6-1-3-7(11)4-2-6/h1-4H,5,11H2
3.InChIKey: OJARUJXBQHAORJ-UHFFFAOYAX

Product Name

4-(5-CHLOROMETHYL-[1,2,4]OXADIAZOL-3-YL)-ANILINE

4-(5-Chloromethyl-1,2,4-oxadiazol-3-yl)aniline Specification

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