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

6-Bromo-4-chlorothieno[2,3-d]pyrimidine

Related Products

Hot Products

Name

6-Bromo-4-chlorothieno[2,3-d]pyrimidine

EINECS N/A
CAS No. 56844-12-3 Density 1.955 g/cm3
PSA 54.02000 LogP 3.10720
Solubility N/A Melting Point N/A
Formula C6H2BrClN2S Boiling Point 345.5 °C at 760 mmHg
Molecular Weight 249.518 Flash Point 162.7 °C
Transport Information N/A Appearance N/A
Safety 45 Risk Codes 25
Molecular Structure Molecular Structure of 56844-12-3 (6-BROMO-4-CHLOROTHIENO[2,3-D]PYRIMIDINE) Hazard Symbols T
Synonyms

6-BROMO-4-CHLOROTHIENO[2,3-D]PYRIMIDINE

Article Data 21

6-Bromo-4-chlorothieno[2,3-d]pyrimidine Specification

The 6-Bromo-4-chlorothieno[2,3-d]pyrimidine, with the CAS registry number 56844-12-3, is also called Thieno[2,3-d]pyrimidine, 6-bromo-4-chloro-. It belongs to the product category of Chiral Chemicals. And the molecular formula of the chemical is C6H2BrClN2S.

The characteristics of this chemical are as followings: (1)ACD/LogP: 2.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.86; (4)ACD/LogD (pH 7.4): 2.86; (5)ACD/BCF (pH 5.5): 88.59; (6)ACD/BCF (pH 7.4): 88.59; (7)ACD/KOC (pH 5.5): 862.09; (8)ACD/KOC (pH 7.4): 862.09; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 54.02 Å2; (13)Index of Refraction: 1.735; (14)Molar Refractivity: 51.24 cm3; (15)Molar Volume: 127.6 cm3; (16)Polarizability: 20.31×10-24cm3; (17)Surface Tension: 69.8 dyne/cm; (18)Density: 1.955 g/cm3; (19)Flash Point: 162.7 °C; (20)Enthalpy of Vaporization: 56.62 kJ/mol; (21)Boiling Point: 345.5 °C at 760 mmHg; (22)Vapour Pressure: 0.000123 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc2ncnc1sc(Br)cc12
(2)InChI: InChI=1/C6H2BrClN2S/c7-4-1-3-5(8)9-2-10-6(3)11-4/h1-2H
(3)InChIKey: CMIXHHOZGMSYKN-UHFFFAOYAO

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 56844-12-3