tert-butyl 2-(pyridin-3-yl)acetate

tert-butyl 2-(pyridin-3-yl)acetate

CAS: 69713-27-5

Formula: C11H15NO2

SMILES: CC(C)(C)OC(=O)CC1=CC=CN=C1

IUPAC: tert-butyl 2-(pyridin-3-yl)acetate

InChI: InChI=1S/C11H15NO2/c1-11(2,3)14-10(13)7-9-5-4-6-12-8-9/h4-6,8H,7H2,1-3H3

Composition: C (68.37%), H (7.82%), N (7.25%), O (16.56%)

Molar Mass: 193.246

Atom Count: 29

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	193.110278727
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	XDIHUIZQEAEIIJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.78
Topological Polar Surface Area	39.19
Polarizability	21.24
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	69713-27-5		$246.72-$580.80$246.72$369.60$580.80