3-Methyl-1H-1,2,4-triazole supplier

Name
3-METHYL-1H-1,2,4-TRIAZOLE
EINECS 615-326-4
CAS No. 7170-01-6
Article Data30
CAS DataBase
Density 1.178 g/cm³
Solubility
Melting Point 44-48°C
Formula C₃H₅N₃
Boiling Point 233.1 °C at 760 mmHg
Molecular Weight 83.0928
Flash Point 114.7 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols 36/37/38:;
Synonyms 1H-1,2,4-Triazole,3-methyl- (9CI);s-Triazole, 3-methyl- (7CI,8CI);3-Methyl-1,2,4-triazole;3-Methyl-1H-1,2,4-triazole;3-Methyl-4H-1,2,4-triazole;3-Methyltriazole;NSC202575;
PSA 41.57000
LogP 0.11310

3-Methyl-1H-1,2,4-triazole Specification

This chemical is called 1H-1,2,4-Triazole,5-methyl-, and its systematic name is 5-methyl-1H-1,2,4-triazole. With the molecular formula of C₃H₅N₃, its molecular weight is 83.09. The CAS registry number of this chemical is 7170-01-6.

Other characteristics of the 1H-1,2,4-Triazole,5-methyl- can be summarised as followings: (1)ACD/LogP: -0.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.74; (4)ACD/LogD (pH 7.4): -0.73; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 9.39; (8)ACD/KOC (pH 7.4): 9.53; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 30.71 Å²; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 21.69 cm³; (15)Molar Volume: 70.4 cm³; (16)Polarizability: 8.59×10^-24cm³; (17)Surface Tension: 56 dyne/cm; (18)Density: 1.178 g/cm³; (19)Flash Point: 114.7 °C; (20)Enthalpy of Vaporization: 46.98 kJ/mol; (21)Boiling Point: 233.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0569 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: n1cnnc1C
2.InChI: InChI=1/C3H5N3/c1-3-4-2-5-6-3/h2H,1H3,(H,4,5,6)
3.InChIKey: PZKFSRWSQOQYNR-UHFFFAOYAX

Product Name

3-METHYL-1H-1,2,4-TRIAZOLE

3-Methyl-1H-1,2,4-triazole Specification

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