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1H-1,4-Benzodiazepin-7-ol,2,3,4,5-tetrahydro-

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Name

1H-1,4-Benzodiazepin-7-ol,2,3,4,5-tetrahydro-

EINECS N/A
CAS No. 886366-76-3 Density 1.136 g/cm3
PSA 44.29000 LogP 1.37410
Solubility N/A Melting Point N/A
Formula C9H12N2O Boiling Point 374.6 °C at 760 mmHg
Molecular Weight 164.20 Flash Point 194.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 886366-76-3 (2,3,4,5-TETRAHYDRO-1H-BENZO[E][1,4]DIAZEPIN-7-OL) Hazard Symbols N/A
Synonyms

1H-1,4-Benzodiazepin-7-ol, 2,3,4,5-tetrahydro-; 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepin-7-ol

 

1H-1,4-Benzodiazepin-7-ol,2,3,4,5-tetrahydro- Specification

This chemical is called 1H-1,4-Benzodiazepin-7-ol, 2,3,4,5-tetrahydro-, and its IUPAC name is 2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-ol. With the molecular formula of C9H12N2O, its molecular weight is 164.20. The CAS registry number of this chemical is 886366-76-3.

Other characteristics of the 1H-1,4-Benzodiazepin-7-ol, 2,3,4,5-tetrahydro- can be summarised as followings: (1)#H bond acceptors: 3; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 44.29 Å2; (5)Index of Refraction: 1.564; (6)Molar Refractivity: 47 cm3; (7)Molar Volume: 144.4 cm3; (8)Polarizability: 18.63×10-24cm3; (9)Surface Tension: 44.9 dyne/cm; (10)Density: 1.136 g/cm3; (11)Flash Point: 194.9 °C; (12)Enthalpy of Vaporization: 64.65 kJ/mol; (13)Boiling Point: 374.6 °C at 760 mmHg; (14)Vapour Pressure: 3.82E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Oc1ccc2NCCNCc2c1
2.InChI: InChI=1/C9H12N2O/c12-8-1-2-9-7(5-8)6-10-3-4-11-9/h1-2,5,10-12H,3-4,6H2
3.InChIKey: JQYCOQDSDCFYKU-UHFFFAOYAB

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