tert-butyl 3-ethynylmorpholine-4-carboxylate

tert-butyl 3-ethynylmorpholine-4-carboxylate

CAS: 833474-07-0

Formula: C11H17NO3

SMILES: CC(C)(C)OC(=O)N1CCOCC1C#C

IUPAC: tert-butyl 3-ethynylmorpholine-4-carboxylate

InChI: InChI=1/C11H17NO3/c1-5-9-8-14-7-6-12(9)10(13)15-11(2,3)4/h1,9H,6-8H2,2-4H3

Composition: C (62.54%), H (8.11%), N (6.63%), O (22.72%)

Molar Mass: 211.261

Atom Count: 32

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	211.120843411
Formal Charge	0
FSP3	0.73
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	UCNLYXLRSYTFSG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.01
Topological Polar Surface Area	38.77
Polarizability	21.79
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	833474-07-0		$470.93-$1,835.06$470.93$865.26$1,835.06