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1,3,5-Triazine-2,4-diamine,N2-ethyl-

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Name

1,3,5-Triazine-2,4-diamine,N2-ethyl-

EINECS N/A
CAS No. 30368-49-1 Density 1.296 g/cm3
PSA N/A LogP N/A
Solubility N/A Melting Point N/A
Formula C5H9N5 Boiling Point 352.4 °C at 760 mmHg
Molecular Weight 139.16 Flash Point 166.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 30368-49-1 (N-ethyl-1,3,5-triazine-2,4-diamine) Hazard Symbols N/A
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;

 

1,3,5-Triazine-2,4-diamine,N2-ethyl- Specification

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

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