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Name	5-Bromo-4-chlorothieno[2,3-d]pyrimidine	EINECS	N/A
CAS No.	814918-95-1	Density	1.955 g/cm³
PSA	54.02000	LogP	3.10720
Solubility	N/A	Melting Point	N/A
Formula	C₆H₂BrClN₂S	Boiling Point	345.453 °C at 760 mmHg
Molecular Weight	249.518	Flash Point	162.724 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	5-Bromo-4-chlorothieno[2,3-d]pyrimidine;

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

The cas register number of 5-Bromo-4-chlorothieno[2,3-d]pyrimidine is 814918-95-1. It also can be called as Thieno[2,3-d]pyrimidine,5-bromo-4-chloro- and the IUPAC Name about this chemical is 5-bromo-4-chlorothieno[2,3-d]pyrimidine.

Physical properties about 5-Bromo-4-chlorothieno[2,3-d]pyrimidine are: (1)ACD/LogP: 2.21; (2)ACD/LogD (pH 5.5): 2.209; (3)ACD/LogD (pH 7.4): 2.209; (4)ACD/BCF (pH 5.5): 28.09; (5)ACD/BCF (pH 7.4): 28.09; (6)ACD/KOC (pH 5.5): 378.869; (7)ACD/KOC (pH 7.4): 378.87; (8)#H bond acceptors: 2; (9)Polar Surface Area: 54.02Å²; (10)Index of Refraction: 1.736; (11)Molar Refractivity: 51.247 cm³; (12)Molar Volume: 127.612 cm³; (13)Polarizability: 20.316x10^-24cm³; (14)Surface Tension: 69.854 dyne/cm; (15)Enthalpy of Vaporization: 56.621 kJ/mol.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C(C2=C(S1)N=CN=C2Cl)Br
(2)InChI: InChI=1S/C6H2BrClN2S/c7-3-1-11-6-4(3)5(8)9-2-10-6/h1-2H
(3)InChIKey: IKCKRHCJPVDELP-UHFFFAOYSA-N

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