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CAS No.: | 55551-49-0 |
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Name: | 2-DIMETHYLAMINO-PYRIMIDINE-5-CARBALDEHYDE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C7H9N3O |
Molecular Weight: | 151.17 |
Synonyms: | 2-(Dimethylamino)pyrimidine-5-carboxaldehyde; |
Density: | 1.204 g/cm3 |
Melting Point: | 122-124 °C |
Boiling Point: | 289.6 °C at 760 mmHg |
Flash Point: | 128.9 °C |
Hazard Symbols: | Xi |
Risk Codes: | 22-43 |
PSA: | 46.09000 |
LogP: | 0.35510 |
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The CAS registry number of 5-Pyrimidinecarboxaldehyde,2-(dimethylamino)- is 55551-49-0. It belongs to the product categories of Building Blocks;Pyrimidine. This chemical is also known as TIMTEC-BB SBB010324. The molecular formula of it is C7H9N3O and molecular weight is 151.17. Its systematic name is called 2-(dimethylamino)pyrimidine-5-carbaldehyde. This Chemical that may cause inflammation to the skin or other mucous membranes.
Physical properties about this chemical are: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Index of Refraction: 1.609; (7)Molar Refractivity: 43.5 cm3; (8)Molar Volume: 125.5 cm3; (9)Surface Tension: 55.5 dyne/cm; (10)Density: 1.204 g/cm3; (11)Flash Point: 128.9 °C; (12)Enthalpy of Vaporization: 52.89 kJ/mol; (13)Boiling Point: 289.6 °C at 760 mmHg; (14)Vapour Pressure: 0.00218 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cnc(nc1)N(C)C
(2)InChI: InChI=1/C7H9N3O/c1-10(2)7-8-3-6(5-11)4-9-7/h3-5H,1-2H3
(3)InChIKey: XBYXYDVSCMMJDT-UHFFFAOYAP