methyl 5-(thiophen-2-yl)pyridine-3-carboxylate

methyl 5-(thiophen-2-yl)pyridine-3-carboxylate

CAS: 893735-01-8

Formula: C11H9NO2S

SMILES: COC(=O)C1=CN=CC(=C1)C1=CC=CS1

IUPAC: methyl 5-(thiophen-2-yl)pyridine-3-carboxylate

InChI: InChI=1S/C11H9NO2S/c1-14-11(13)9-5-8(6-12-7-9)10-3-2-4-15-10/h2-7H,1H3

Composition: C (60.26%), H (4.14%), N (6.39%), O (14.59%), S (14.62%)

Molar Mass: 219.26

Atom Count: 24

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	219.035399708
Formal Charge	0
FSP3	0.09
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RDFRFBDTMUDSRT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.95
Topological Polar Surface Area	39.19
Polarizability	23.46
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	893735-01-8		$117.27-$551.06$117.27$199.24$551.06