4-chloro-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine

4-chloro-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine

CAS: 1211520-73-8

Formula: C7H3ClF3N3

SMILES: FC(F)(F)C1=CNC2=NC=NC(Cl)=C12

IUPAC: 4-chloro-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine

InChI: InChI=1S/C7H3ClF3N3/c8-5-4-3(7(9,10)11)1-12-6(4)14-2-13-5/h1-2H,(H,12,13,14)

Composition: C (37.95%), H (1.36%), Cl (16.00%), F (25.72%), N (18.97%)

Molar Mass: 221.57

Atom Count: 17

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	220.9967593
Formal Charge	0
FSP3	0.14
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XTQGBMSLTHSCEX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.6
Topological Polar Surface Area	41.57
Polarizability	16.43
Ring Count	2
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1211520-73-8		$341.73-$1,408.54$341.73$564.93$939.45$1,408.54