1,3,5-Triazine-2,4-diamine,6-pentadecyl- supplier

Name
6-pentadecyl-1,3,5-triazine-2,4-diamine
EINECS 253-571-5
CAS No. 37623-51-1
Density 1.001 g/cm³
Solubility
Melting Point
Formula C₁₈H₃₅N₅
Boiling Point 515.844 °C at 760 mmHg
Molecular Weight 321.509
Flash Point 298.619 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms s-Triazine,2,4-diamino-6-pentadecyl-;
PSA 92.17000
LogP 4.52990

1,3,5-Triazine-2,4-diamine,6-pentadecyl- Specification

The 1,3,5-Triazine-2,4-diamine,6-pentadecyl- is an organic compound with the formula C₁₈H₃₅N₅. With the CAS registry number 37623-51-1, the systematic name of this chemical is 6-pentadecyl-1,3,5-triazine-2,4-diamine.

Physical properties about 1,3,5-Triazine-2,4-diamine,6-pentadecyl- are: (1)ACD/LogP: 8.02; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7; (4)ACD/LogD (pH 7.4): 7; (5)ACD/BCF (pH 5.5): 108716; (6)ACD/BCF (pH 7.4): 133417; (7)ACD/KOC (pH 5.5): 132107; (8)ACD/KOC (pH 7.4): 162123; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 90.71 Å²; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 98.775 cm³; (15)Molar Volume: 321.07 cm³; (16)Polarizability: 39.158×10^-24cm³; (17)Surface Tension: 45.784 dyne/cm; (18)Density: 1.001 g/cm³; (19)Flash Point: 298.619 °C; (20)Enthalpy of Vaporization: 78.78 kJ/mol; (21)Boiling Point: 515.844 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c(nc(nc1CCCCCCCCCCCCCCC)N)N
(2)InChI: InChI=1/C18H35N5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-17(19)23-18(20)22-16/h2-15H2,1H3,(H4,19,20,21,22,23)
(3)InChIKey: JZSZJXLPSQTWSS-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C18H35N5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-17(19)23-18(20)22-16/h2-15H2,1H3,(H4,19,20,21,22,23)
(5)Std. InChIKey: JZSZJXLPSQTWSS-UHFFFAOYSA-N

Product Name

6-pentadecyl-1,3,5-triazine-2,4-diamine

1,3,5-Triazine-2,4-diamine,6-pentadecyl- Specification

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