1H-Benzotriazol-4-ol supplier

Name
4-HYDROXYBENZOTRIAZOLE
EINECS
CAS No. 26725-51-9
Density 1.557 g/cm³
Solubility
Melting Point 224 °C (dec.)
Formula C₆H₅N₃O
Boiling Point 473.027 °C at 760 mmHg
Molecular Weight 135.125
Flash Point 239.878 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 20/21/22-36/37/38
Molecular Structure
Hazard Symbols Xi,Xn
Synonyms 1H-Benzotriazol-4-ol(8CI,9CI);Benzotriazol-4-ol (7CI);4-Hydroxybenzotriazole;
PSA 61.80000
LogP 0.66350

1H-Benzotriazol-4-ol Specification

This chemical is called 1H-Benzotriazol-4-ol, and its CAS registry number is 26725-51-9. With the molecular formula of C₆H₅N₃O, its molecular weight is 135.12. Additionally, its product categories are API Intermediates; Benzotriazoles; Building Blocks; Heterocyclic Building Blocks. It should be sealed in the cool and dry plcace, away from oxides.

Other characteristics of the 1H-Benzotriazol-4-ol can be summarised as followings: (1)ACD/LogP: 0.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 9; (6)ACD/BCF (pH 7.4): 5; (7)ACD/KOC (pH 5.5): 164; (8)ACD/KOC (pH 7.4): 92; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 61.8 Å²; (13)Index of Refraction: 1.786; (14)Molar Refractivity: 36.593 cm³; (15)Molar Volume: 86.749 cm³; (16)Polarizability: 14.506×10^-24cm³; (17)Surface Tension: 99.556 dyne/cm; (18)Density: 1.558 g/cm³; (19)Flash Point: 239.878 °C; (20)Enthalpy of Vaporization: 76.419 kJ/mol; (21)Boiling Point: 473.027 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Oc2cccc1nnnc12
2.InChI: InChI=1/C6H5N3O/c10-5-3-1-2-4-6(5)8-9-7-4/h1-3,10H,(H,7,8,9)
3.InChIKey: JMTMSDXUXJISAY-UHFFFAOYAH

Product Name

4-HYDROXYBENZOTRIAZOLE

1H-Benzotriazol-4-ol Specification

Related Products

Hot Products