6-chloro-N4-methyl-pyrimidine-4,5-diamine supplier

Name
6-chloro-N-methyl-pyrimidine-4,5-diamine
EINECS
CAS No. 52602-68-3
Article Data9
CAS DataBase
Density 1.447 g/cm³
Solubility
Melting Point 62℃
Formula C₅H₇ClN₄
Boiling Point 328.2 °C at 760 mmHg
Molecular Weight 158.5889
Flash Point 152.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (5-Amino-6-chloropyrimidin-4-yl)methylamine;
PSA 63.83000
LogP 1.40810

6-chloro-N4-methyl-pyrimidine-4,5-diamine Specification

The 6-chloro-N4-methyl-pyrimidine-4,5-diamine, with the CAS registry number 52602-68-3, is also known as Pyrimidine, 5-amino-6-chloro-4-(methylamino)-. Its molecular formula is C₅H₇ClN₄ and its molecular weight is 158.5889. What's more, the IUPAC name of this chemical is 6-Chloro-N⁴-methylpyrimidine-4,5-diamine.

Physical properties about the 6-chloro-N4-methyl-pyrimidine-4,5-diamine are: (1)ACD/LogP: -0.20; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.35; (4)ACD/LogD (pH 7.4): 2.35; (5)ACD/BCF (pH 5.5): 35.73; (6)ACD/BCF (pH 7.4): 36.19; (7)ACD/KOC (pH 5.5): 448.39; (8)ACD/KOC (pH 7.4): 454.18; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 32.26 Å²; (13)Index of Refraction: 1.675; (14)Molar Refractivity: 41.17 cm³; (15)Molar Volume: 109.5 cm³; (16)Surface Tension: 69.3 dyne/cm; (17)Density: 1.447 g/cm³; (18)Flash Point: 152.3 °C; (19)Enthalpy of Vaporization: 57.06 kJ/mol; (20)Boiling Point: 328.2 °C at 760 mmHg; (21)Vapour Pressure: 0.000192 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ncnc(NC)c1N
(2) InChI: InChI=1/C5H7ClN4/c1-8-5-3(7)4(6)9-2-10-5/h2H,7H2,1H3,(H,8,9,10)
(3) InChIKey: RIYBSFHJIOZYLD-UHFFFAOYAL

Product Name

6-chloro-N-methyl-pyrimidine-4,5-diamine

6-chloro-N4-methyl-pyrimidine-4,5-diamine Specification

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