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623564-38-5

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Basic Information
CAS No.: 623564-38-5
Name: 5H-Pyrrolo[1,2-a]imidazole-2-carboxaldehyde,6,7-dihydro-(9CI)
Article Data: 2
Molecular Structure:
Molecular Structure of 623564-38-5 (5H-Pyrrolo[1,2-a]imidazole-2-carboxaldehyde,6,7-dihydro-(9CI))
Formula: C7H8N2O
Molecular Weight: 136.153
Synonyms: 6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole-2-carboxaldehyde;
Density: 1.351 g/cm3
Boiling Point: 351.899 °C at 760 mmHg
Flash Point: 166.623 °C
Hazard Symbols: IrritantXi
Risk Codes: 43
Safety: 36/37
PSA: 34.89000
LogP: 0.64180
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Specification

The CAS register number of 6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole-2-carboxaldehyde is 623564-38-5. It also can be called as 5H-pyrrolo[1,2-a]imidazole-2-carboxaldehyde, 6,7-dihydro- and the IUPAC name about this chemical is 6,7-dihydro-5H-pyrrolo[1,2-a]imidazole-2-carbaldehyde. The molecular formula about this chemical is C7H8N2O and molecular weight is 136.15. It belongs to the following product categories which include Aminetertiary; Intermediates and so on.

Physical properties about 6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole-2-carboxaldehyde are: (1)ACD/LogP: 0.42; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 8; (5)ACD/KOC (pH 7.4): 8; (6)#H bond acceptors: 3; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 34.89Å2; (9)Index of Refraction: 1.668; (10)Molar Refractivity: 37.565 cm3; (11)Molar Volume: 100.796 cm3; (12)Polarizability: 14.892x10-24cm3; (13)Surface Tension: 55.059 dyne/cm; (14)Flash Point: 166.623 °C; (15)Enthalpy of Vaporization: 59.666 kJ/mol; (16)Boiling Point: 351.899 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cn2CCCc2n1
(2)InChI: InChI=1/C7H8N2O/c10-5-6-4-9-3-1-2-7(9)8-6/h4-5H,1-3H2
(3)InChIKey: IFOAVNDPIZTQMU-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C7H8N2O/c10-5-6-4-9-3-1-2-7(9)8-6/h4-5H,1-3H2
(5)Std. InChIKey: IFOAVNDPIZTQMU-UHFFFAOYSA-N