AG0011OU

1363381-20-7 | 5-Oxa-2,8-diazaspiro[3.5]nonane-2-carboxylic acid, 7-oxo-, 1,1-dimethylethyl ester

AG0011OU

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CAS Number	1363381-20-7
Catalog Number	AG0011OU(AGN-PC-0WCKPR)
Chemical Name	5-Oxa-2,8-diazaspiro[3.5]nonane-2-carboxylic acid, 7-oxo-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 7-oxo-5-oxa-2,8-diazaspiro[3.5]nonane-2-carboxylate
InChI	InChI=1S/C11H18N2O4/c1-10(2,3)17-9(15)13-6-11(7-13)5-12-8(14)4-16-11/h4-7H2,1-3H3,(H,12,14)
InChI Key	XVGAQOILVLJWLR-UHFFFAOYSA-N
MDL Number	MFCD22566166
Molecular Formula	C11H18N2O4
Molecular Weight	242.2716
SMILES	O=C(NC1)COC21CN(C(OC(C)(C)C)=O)C2
Synonyms	2-BOC-5-OXA-2,8-DIAZA-SPIRO[3.5]NONAN-7-ONE, 1363381-20-7, tert-butyl 7-oxo-5-oxa-2,8-diazaspiro[3.5]nonane-2-carboxylate, KS-00001BVH, MFCD22566166, ZINC95743329, AKOS025403525, FCH2891646, PB38128, AK184941, CS-0028386, Q-4630, F2147-3394, 5-Oxa-2,8-diazaspiro[3.5]nonane-2-carboxylic acid, 7-oxo-, 1,1-dimethylethyl ester,

Complexity	342
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.127g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.275g/mol
Monoisotopic Mass	242.127g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	67.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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