2,4,6-trichlorothieno[3,2-d]pyrimidine

2,4,6-trichlorothieno[3,2-d]pyrimidine

CAS: 41102-26-5

Formula: C6HCl3N2S

SMILES: ClC1=CC2=NC(Cl)=NC(Cl)=C2S1

IUPAC: 2,4,6-trichlorothieno[3,2-d]pyrimidine

InChI: InChI=1S/C6HCl3N2S/c7-3-1-2-4(12-3)5(8)11-6(9)10-2/h1H

Composition: C (30.09%), H (0.42%), Cl (44.41%), N (11.70%), S (13.39%)

Molar Mass: 239.5

Atom Count: 13

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	237.8926023
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	YTBCURLKGMTHAH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.02
Topological Polar Surface Area	25.78
Polarizability	20.75
Ring Count	2
Rotatable Bond Count	0

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