Compound C13H14N2O6

tert-butyl 5-methyl-3-(5-nitrofuran-2-yl)-1,2-oxazole-4-carboxylate

CAS: 22996-62-9

Molecular Formula	`C13H14N2O6`
Molecular Weight	294.26 g/mol
LogP	2.5
Topological Polar Surface Area	111.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	4
Exact Mass	294.08517
Heavy Atoms	21
Complexity	416.0

Chemical Identifiers

CAS Number	22996-62-9
SMILES	`CC1=C(C(=NO1)C2=CC=C(O2)[N+](=O)[O-])C(=O)OC(C)(C)C`
InChIKey	`BOPGHMJTSIFKBY-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H14N2O6 (CAS: 22996-62-9) is a chemical compound with molecular formula C13H14N2O6 and molecular weight 294.26 g/mol. Its IUPAC systematic name is tert-butyl 5-methyl-3-(5-nitrofuran-2-yl)-1,2-oxazole-4-carboxylate. LogP 2.5 Topological Polar Surface Area 111.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 7 Rotatable Bonds 4 Exact Mass 294.08517 Heavy Atoms 21 Complexity 416.0 InChI Key: BOPGHMJTSIFKBY-UHFFFAOYSA-N. SMILES: CC1=C(C(=NO1)C2=CC=C(O2)[N+](=O)[O-])C(=O)OC(C)(C)C.

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