Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

5-Cyano-4,6-dichloro-2-(methylthio)pyrimidine

Related Products

Hot Products

Name

5-Cyano-4,6-dichloro-2-(methylthio)pyrimidine

EINECS N/A
CAS No. 33097-13-1 Density 1.58 g/cm3
PSA 74.87000 LogP 2.37698
Solubility N/A Melting Point 103-105°C
Formula C6H3Cl2N3S Boiling Point 367.3 °C at 760 mmHg
Molecular Weight 220.082 Flash Point 175.9 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39-45 Risk Codes 25-34
Molecular Structure Molecular Structure of 33097-13-1 (4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDINE-5-CARBONITRILE) Hazard Symbols T,C
Synonyms

4,6-Dichloro-2-(methylthio)-5-pyrimidinecarbonitrile;4,6-Dichloro-2-methylsulfanylpyrimidine-5-carbonitrile;

Article Data 9

5-Cyano-4,6-dichloro-2-(methylthio)pyrimidine Specification

The 5-Pyrimidinecarbonitrile,4,6-dichloro-2-(methylthio)- with CAS registry number of 33097-13-1 is also known as 5-Cyano-4,6-dichloro-2-(methylthio)pyrimidine. The IUPAC name is 4,6-Dichloro-2-methylsulfanylpyrimidine-5-carbonitrile. It belongs to product categories of Heterocyclic Compounds; Bases & Related Reagents; Heterocycles; Nucleotides; Sulfur & Selenium Compounds. In addition, the formula is C6H3Cl2N3S and the molecular weight is 220.08.

Physical properties about 5-Pyrimidinecarbonitrile,4,6-dichloro-2-(methylthio)- are: (1)ACD/LogP: 1.58; (2)ACD/LogD (pH 5.5): 1.58; (3)ACD/LogD (pH 7.4): 1.58; (4)ACD/BCF (pH 5.5): 9.37; (5)ACD/BCF (pH 7.4): 9.37; (6)ACD/KOC (pH 5.5): 172.65; (7)ACD/KOC (pH 7.4): 172.65; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Index of Refraction: 1.629; (11)Molar Refractivity: 49.21 cm3; (12)Molar Volume: 138.4 cm3; (13)Surface Tension: 76.2 dyne/cm; (14)Density: 1.58 g/cm3; (15)Flash Point: 175.9 °C; (16)Enthalpy of Vaporization: 61.38 kJ/mol; (17)Boiling Point: 367.3 °C at 760 mmHg; (18)Vapour Pressure: 1.38E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES:Clc1nc(SC)nc(Cl)c1C#N
2. InChI:InChI=1/C6H3Cl2N3S/c1-12-6-10-4(7)3(2-9)5(8)11-6/h1H3
3. InChIKey:GLOOTGZVAHKTJS-UHFFFAOYAA
4. Std. InChI:InChI=1S/C6H3Cl2N3S/c1-12-6-10-4(7)3(2-9)5(8)11-6/h1H3
5. Std. InChIKey:GLOOTGZVAHKTJS-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 33097-13-1