2-Pyrimidinamine,4,5,6-trichloro- supplier

Name
4,5,6-trichloropyrimidin-2-amine
EINECS 604-604-1
CAS No. 51501-53-2
Article Data4
CAS DataBase
Density 1.74 g/cm³
Solubility
Melting Point 236-237 °C
Formula C₄H₂Cl₃N₃
Boiling Point 386.3 °C at 760 mmHg
Molecular Weight 198.439
Flash Point 187.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-4,5,6-trichloropyrimidine;4,5,6-Trichloro-2-aminopyrimidine;NSC 403354;
PSA 51.80000
LogP 2.60020

2-Pyrimidinamine,4,5,6-trichloro- Specification

The 2-Pyrimidinamine,4,5,6-trichloro- is an organic compound with the formula C₄H₂Cl₃N₃. The IUPAC name of this chemical is 4,5,6-Trichloropyrimidin-2-amine. The CAS registry number of this chemical is 51501-53-2. Besides, its molecular weight is 198.4378.

The physical properties of 2-Pyrimidinamine,4,5,6-trichloro- are: (1)ACD/LogP: 1.33; (2)ACD/LogD (pH 5.5): 1.33; (3)ACD/LogD (pH 7.4): 1.33; (4)ACD/BCF (pH 5.5): 6.01; (5)ACD/BCF (pH 7.4): 6.01; (6)ACD/KOC (pH 5.5): 125.62; (7)ACD/KOC (pH 7.4): 125.62; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)Polar Surface Area: 29.02 Å²; (11)Index of Refraction: 1.645; (12)Molar Refractivity: 41.35 cm³; (13)Molar Volume: 114 cm³; (14)Polarizability: 16.39×10^-24 cm³; (15)Surface Tension: 69.3 dyne/cm; (16)Density: 1.74 g/cm³; (17)Flash Point: 187.4 °C; (18)Enthalpy of Vaporization: 63.53 kJ/mol; (19)Boiling Point: 386.3 °C at 760 mmHg; (20)Vapour Pressure: 3.57E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c(Cl)nc(nc1Cl)N
(2)InChI: InChI=1/C4H2Cl3N3/c5-1-2(6)9-4(8)10-3(1)7/h(H2,8,9,10)
(3)InChIKey: PQUTUCGOBIRQIH-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C4H2Cl3N3/c5-1-2(6)9-4(8)10-3(1)7/h(H2,8,9,10)
(5)Std. InChIKey: PQUTUCGOBIRQIH-UHFFFAOYSA-N

Product Name

4,5,6-trichloropyrimidin-2-amine

2-Pyrimidinamine,4,5,6-trichloro- Specification

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