AG003APD

1523570-96-8 | 2-Oxa-6-azaspiro[3.4]octane hemioxalate

AG003APD

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CAS Number	1523570-96-8
Catalog Number	AG003APD(AGN-PC-0WQUQD)
Chemical Name	2-Oxa-6-azaspiro[3.4]octane hemioxalate
IUPAC Name	2-oxa-7-azaspiro[3.4]octane;oxalic acid
InChI	InChI=1S/2C6H11NO.C2H2O4/c2*1-2-7-3-6(1)4-8-5-6;3-1(4)2(5)6/h2*7H,1-5H2;(H,3,4)(H,5,6)
InChI Key	DREVFFJHSWBTQS-UHFFFAOYSA-N
MDL Number	MFCD22422280
Molecular Formula	C14H24N2O6
Molecular Weight	316.3502
SMILES	O=C(O)C(O)=O.C1OCC21CNCC2.C3OCC43CNCC4
Synonyms	2-oxa-6-azaspiro[3.4]octane hemioxalate, 1523570-96-8, DREVFFJHSWBTQS-UHFFFAOYSA-N, MFCD22422280, AKOS025212137, SB10176, AK166961, AS-33475, OR317031, ST1020077, CS-0051825, 2-oxa-6-azaspiro[3.4]octane hemioxalate salt, 1408075-00-2,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	316.163g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	316.354g/mol
Monoisotopic Mass	316.163g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	117A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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