1-(5-Pyrimidinyl)ethanamine supplier

Name
5-Pyrimidinemethanamine, alpha-methyl- (9CI)
EINECS
CAS No. 179323-61-6
Article Data2
CAS DataBase
Density 1.089 g/cm³
Solubility
Melting Point
Formula C₆H₉N₃
Boiling Point 220.357 °C at 760 mmHg
Molecular Weight 123.158
Flash Point 109.532 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-(1-Aminoethyl)pyrimidine;
PSA 51.80000
LogP 1.19660

1-(5-Pyrimidinyl)ethanamine Specification

The 1-(5-Pyrimidinyl)ethanamine, with the CAS registry number 179323-61-6, is also known as 5-(1-Aminoethyl)pyrimidine. It belongs to the product category of Pyrimidine. This chemical's molecular formula is C₆H₉N₃ and molecular weight is 123.16. What's more, its systematic name is 1-(5-Pyrimidinyl)ethanamine.

Physical properties of 1-(5-Pyrimidinyl)ethanamine are: (1)ACD/LogP: -1.115; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.32; (4)ACD/LogD (pH 7.4): -1.63; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.79; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 51.8 Å²; (13)Index of Refraction: 1.54; (14)Molar Refractivity: 35.523 cm³; (15)Molar Volume: 113.124 cm³; (16)Polarizability: 14.082×10^-24cm³; (17)Surface Tension: 49.4 dyne/cm; (18)Density: 1.089 g/cm³; (19)Flash Point: 109.532 °C; (20)Enthalpy of Vaporization: 45.678 kJ/mol; (21)Boiling Point: 220.357 °C at 760 mmHg; (22)Vapour Pressure: 0.1 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(N)c1cncnc1
(2)Std. InChI: InChI=1S/C6H9N3/c1-5(7)6-2-8-4-9-3-6/h2-5H,7H2,1H3
(3)Std. InChIKey: GWCPZMRPJBYIFM-UHFFFAOYSA-N

Product Name

5-Pyrimidinemethanamine, alpha-methyl- (9CI)

1-(5-Pyrimidinyl)ethanamine Specification

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