6H-Pyrrolo[3,4-d]pyrimidine supplier

Name
6H-Pyrrolo[3,4-d]pyrimidine (8CI)
EINECS
CAS No. 20438-17-9
Density 1.349 g/cm³
Solubility
Melting Point
Formula C₆H₅N₃
Boiling Point 315.263 °C at 760 mmHg
Molecular Weight 119.124
Flash Point 158.812 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms EN000788;
PSA
LogP

6H-Pyrrolo[3,4-d]pyrimidine Specification

The 6H-Pyrrolo[3,4-d]pyrimidine, with the CAS registry number 20438-17-9, is also known as EN000788. It belongs to the product category of Pyrimidine. This chemical's molecular formula is C₆H₅N₃ and molecular weight is 119.124. Its IUPAC name is called 6H-pyrrolo[3,4-d]pyrimidine.

Physical properties of 6H-Pyrrolo[3,4-d]pyrimidine: (1)ACD/LogP: -0.33; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 16; (5)ACD/KOC (pH 7.4): 16; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)Index of Refraction: 1.715; (9)Molar Refractivity: 34.711 cm³; (10)Molar Volume: 88.319 cm³; (11)Surface Tension: 73.965 dyne/cm; (12)Density: 1.349 g/cm³; (13)Flash Point: 158.812 °C; (14)Enthalpy of Vaporization: 53.432 kJ/mol; (15)Boiling Point: 315.263 °C at 760 mmHg; (16)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C2C=NC=NC2=CN1
(2)InChI: InChI=1S/C6H5N3/c1-5-2-8-4-9-6(5)3-7-1/h1-4,7H
(3)InChIKey: OWXGCRGZFPLHJN-UHFFFAOYSA-N

Product Name

6H-Pyrrolo[3,4-d]pyrimidine (8CI)

6H-Pyrrolo[3,4-d]pyrimidine Specification

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