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2-Dimethylaminopyrimidine-5-carbaldehyde

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Name

2-Dimethylaminopyrimidine-5-carbaldehyde

EINECS N/A
CAS No. 55551-49-0 Density 1.204 g/cm3
PSA 46.09000 LogP 0.35510
Solubility N/A Melting Point 122-124 °C
Formula C7H9N3O Boiling Point 289.6 °C at 760 mmHg
Molecular Weight 151.17 Flash Point 128.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes 22-43
Molecular Structure Molecular Structure of 55551-49-0 (2-DIMETHYLAMINO-PYRIMIDINE-5-CARBALDEHYDE) Hazard Symbols IrritantXi
Synonyms

2-(Dimethylamino)pyrimidine-5-carboxaldehyde;

Article Data 8

2-Dimethylaminopyrimidine-5-carbaldehyde Specification

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

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