5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro- supplier

Name
6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole
EINECS
CAS No. 59646-16-1
Article Data1
CAS DataBase
Density 1.23 g/cm³
Solubility
Melting Point
Formula C₆H₈N₂
Boiling Point 260.8 °C at 760 mmHg
Molecular Weight 108.14
Flash Point 111.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole;
PSA 17.82000
LogP 0.82930

5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro- Specification

This chemical is called 5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro-, and its systematic name is 6,7-dihydro-5H-pyrrolo[1,2-a]imidazole. With the molecular formula of C₆H₈N₂, its molecular weight is 108.14. The CAS registry number of this chemical is 59646-16-1.

Other characteristics of the 5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro- can be summarised as followings: (1)ACD/LogP: -0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.32; (4)ACD/LogD (pH 7.4): -0.77; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 5.27; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.82 Å²; (13)Index of Refraction: 1.657; (14)Molar Refractivity: 32.1 cm³; (15)Molar Volume: 87.2 cm³; (16)Polarizability: 12.72×10^-24cm³; (17)Surface Tension: 48.6 dyne/cm; (18)Density: 1.23 g/cm³; (19)Flash Point: 111.5 °C; (20)Enthalpy of Vaporization: 47.84 kJ/mol; (21)Boiling Point: 260.8 °C at 760 mmHg; (22)Vapour Pressure: 0.0194 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: n1ccn2c1CCC2
2.InChI: InChI=1/C6H8N2/c1-2-6-7-3-5-8(6)4-1/h3,5H,1-2,4H2
3.InChIKey: ZWETXQBHVRWLPW-UHFFFAOYAC

Product Name

6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole

5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro- Specification

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