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CAS No.: | 30368-49-1 |
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Name: | N-ethyl-1,3,5-triazine-2,4-diamine |
Molecular Structure: | |
Formula: | C5H9N5 |
Molecular Weight: | 139.16 |
Synonyms: | 1,3,5-Triazine-2,4-diamine,N-ethyl- (9CI);Triazine, 2-amino-4-ethylamino- (6CI);s-Triazine,2-amino-4-(ethylamino)- (7CI,8CI);2-Amino-4-(ethylamino)-s-triazine;N-Ethyl-1,3,5-triazine-2,4-diamine; |
Density: | 1.296 g/cm3 |
Boiling Point: | 352.4 °C at 760 mmHg |
Flash Point: | 166.9 °C |
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The 1,3,5-Triazine-2,4-diamine,N2-ethyl-, with the CAS registry number 30368-49-1, is also known as 2-Amino-4-(ethylamino)-s-triazine. This chemical's molecular formula is C5H9N5 and molecular weight is 139.16. What's more, its systematic name is N-Ethyl-1,3,5-triazine-2,4-diamine.
Physical properties of 1,3,5-Triazine-2,4-diamine,N2-ethyl- are: (1)ACD/LogP: -1.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.5; (4)ACD/LogD (pH 7.4): -1.44; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.46; (8)ACD/KOC (pH 7.4): 3.91; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 45.15 Å2; (13)Index of Refraction: 1.646; (14)Molar Refractivity: 39 cm3; (15)Molar Volume: 107.3 cm3; (16)Polarizability: 15.46×10-24cm3; (17)Surface Tension: 73.4 dyne/cm; (18)Density: 1.296 g/cm3; (19)Flash Point: 166.9 °C; (20)Enthalpy of Vaporization: 59.72 kJ/mol; (21)Boiling Point: 352.4 °C at 760 mmHg; (22)Vapour Pressure: 3.86E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n1c(nc(nc1)NCC)N
(2)InChI: InChI=1S/C5H9N5/c1-2-7-5-9-3-8-4(6)10-5/h3H,2H2,1H3,(H3,6,7,8,9,10)
(3)InChIKey: ZCMOXKOUKFOYFB-UHFFFAOYSA-N