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1-Pentoxybenzotriazole

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Name

1-Pentoxybenzotriazole

EINECS N/A
CAS No. 60455-00-7 Density 1.14 g/cm3
PSA N/A LogP N/A
Solubility N/A Melting Point N/A
Formula C11H15N3O Boiling Point 308.5 °C at 760 mmHg
Molecular Weight 205.26 Flash Point 140.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 60455-00-7 (1-(pentyloxy)-1H-benzotriazole) Hazard Symbols N/A
Synonyms

1-(Pentyloxy)-1H-benzotriazole;

Article Data 3

1-Pentoxybenzotriazole Specification

The 1-Pentoxybenzotriazole, with the CAS registry number 60455-00-7. This chemical's molecular formula is C11H15N3O and molecular weight is 205.26. What's more, its systematic name is 1-(Pentyloxy)-1H-benzotriazole.

Physical properties of 1-Pentoxybenzotriazole are: (1)ACD/LogP: 3.87; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 39.94 Å2; (7)Index of Refraction: 1.58; (8)Molar Refractivity: 59.4 cm3; (9)Molar Volume: 178.4 cm3; (10)Polarizability: 23.55×10-24 cm3; (11)Surface Tension: 42.1 dyne/cm; (12)Density: 1.14 g/cm3; (13)Flash Point: 140.3 °C; (14)Enthalpy of Vaporization: 54.91 kJ/mol; (15)Boiling Point: 308.5 °C at 760 mmHg; (16)Vapour Pressure: 0.00068 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1nn(OCCCCC)c2ccccc12
(2)InChI: InChI=1/C11H15N3O/c1-2-3-6-9-15-14-11-8-5-4-7-10(11)12-13-14/h4-5,7-8H,2-3,6,9H2,1H3
(3)InChIKey: AXZTWHHHIRFDOQ-UHFFFAOYAQ

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