Basic Information | Post buying leads | Suppliers |
Name |
Ethyl 2,4-diamino-pyrimidine-5-carboxylate |
EINECS | N/A |
CAS No. | 15400-54-1 | Density | 1.351 g/cm3 |
PSA | 104.12000 | LogP | 0.98010 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H10N4O2 | Boiling Point | 413.882 °C at 760 mmHg |
Molecular Weight | 182.182 | Flash Point | 204.109 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC 9314; |
The 5-Pyrimidinecarboxylicacid, 2,4-diamino-, ethyl ester is an organic compound with the formula C7H10N4O2. The IUPAC name of this chemical is Ethyl 2,4-diaminopyrimidine-5-carboxylate. And the CAS registry number of this chemical is 15400-54-1. The product's categories are Building Blocks; Pyrimidine. Besides, its molecular weight is 182.18.
Physical properties about 5-Pyrimidinecarboxylicacid, 2,4-diamino-, ethyl ester are: (1)ACD/LogP: 1.01; (2)ACD/LogD (pH 5.5): 0.843; (3)ACD/LogD (pH 7.4): 1.002; (4)ACD/BCF (pH 5.5): 2.352; (5)ACD/BCF (pH 7.4): 3.398; (6)ACD/KOC (pH 5.5): 57.719; (7)ACD/KOC (pH 7.4): 83.397; (8)#H bond acceptors: 6; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 104.12 Å2; (12)Index of Refraction: 1.619; (13)Molar Refractivity: 47.314 cm3; (14)Molar Volume: 134.841 cm3; (15)Polarizability: 18.757×10-24 cm3; (16)Surface Tension: 71.331 dyne/cm; (17)Density: 1.351 g/cm3; (18)Flash Point: 204.109 °C; (19)Enthalpy of Vaporization: 66.673 kJ/mol; (20)Boiling Point: 413.882 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C7H10N4O2/c1-2-13-6(12)4-3-10-7(9)11-5(4)8/h3H,2H2,1H3,(H4,8,9,10,11)
(2)InChIKey: MANFWSKJPOXKJZ-UHFFFAOYAG
(3)Std. InChI: InChI=1S/C7H10N4O2/c1-2-13-6(12)4-3-10-7(9)11-5(4)8/h3H,2H2,1H3,(H4,8,9,10,11)
(4)Std. InChIKey: MANFWSKJPOXKJZ-UHFFFAOYSA-N