ethyl 2-(3-fluorophenyl)-1,3-thiazole-5-carboxylate

ethyl 2-(3-fluorophenyl)-1,3-thiazole-5-carboxylate

CAS: 886369-79-5

Formula: C12H10FNO2S

SMILES: CCOC(=O)C1=CN=C(S1)C1=CC=CC(F)=C1

IUPAC: ethyl 2-(3-fluorophenyl)-1,3-thiazole-5-carboxylate

InChI: InChI=1S/C12H10FNO2S/c1-2-16-12(15)10-7-14-11(17-10)8-4-3-5-9(13)6-8/h3-7H,2H2,1H3

Composition: C (57.36%), H (4.01%), F (7.56%), N (5.57%), O (12.73%), S (12.76%)

Molar Mass: 251.28

Atom Count: 27

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	251.041627903
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	PIIGTUHXTVQOFW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.14
Topological Polar Surface Area	39.19
Polarizability	24.38
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	886369-79-5		$311.47-$596.45$311.47$596.45