AG0033F6

1045709-32-7 | 2-Oxa-6-azaspiro[3.3]heptane oxalate（2:1）

AG0033F6

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CAS Number	1045709-32-7
Catalog Number	AG0033F6(AGN-PC-0WQWKS)
Chemical Name	2-Oxa-6-azaspiro[3.3]heptane oxalate（2:1）
IUPAC Name	2-oxa-6-azaspiro[3.3]heptane;oxalic acid
InChI	InChI=1S/2C5H9NO.C2H2O4/c2*1-5(2-6-1)3-7-4-5;3-1(4)2(5)6/h2*6H,1-4H2;(H,3,4)(H,5,6)
InChI Key	RXBYDYSXIHJXNO-UHFFFAOYSA-N
MDL Number	MFCD16652332
Molecular Formula	C12H20N2O6
Molecular Weight	288.2970
SMILES	C(C(=O)O)(=O)O.C1OCC12CNC2.C2OCC21CNC1
Synonyms	1045709-32-7, 2-oxa-6-azaspiro[3.3]heptane hemioxalate, 2-Oxa-6-azaspiro[3.3]heptane oxalate (2:1), 2-OXA-6-AZASPIRO[3.3]HEPTANE OXALATE(2:1), bis(2-oxa-6-azaspiro[3.3]heptane); oxalic acid, 2-Oxa-6-azaspiro[3.3]heptane oxalate2:1, 2C5H9NO.C2H2O4, SCHEMBL15972067, CTK8C0140, RXBYDYSXIHJXNO-UHFFFAOYSA-N, BCP22372, CS-B0204, 3188AH, ANW-64240, MFCD16652332, AKOS016000178, ACN-052278, MCULE-6536774895, NE52344, SB21630, KS-000002B4, AK-75683, SC-22336, SY027603, 4CH-011027, bis(2-oxa-6-azaspiro[3.3]heptane) oxalate, EN300-81038, MFCD16652332 (95%), 2-oxa-6-azaspiro[3.3]heptane hemioxalate salt, 2-oxa-6-azoniaspiro[3.3]heptane oxalate salt, 2-oxa-6-azonia-spiro[3.3]heptane oxalate salt, 2-OXA-6-AZONIASPIRO[3.3]HEPTANE OXALATE, J-510186, 2-Oxa-6-azaspiro[3.3]heptane oxalic acid salt (2:1), Z1270387194, 2-oxa-6-azaspiro[3.3]heptane, MFCD11976178, ACN-031731, 2'-cyano-1,1'-biphenyl-2-carboxylic acid, 2-Oxa-6-aza-spiro[3.3]heptane oxalic acid salt, 2-Oxa-6-azaspiro[3.3]heptane, ethanedioate (2:1), 2-Oxa-6-aza-spiro[3,3]heptane-6-carboxylic acid tert-Butyl ester, 1159599-99-1,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	288.132g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	288.3g/mol
Monoisotopic Mass	288.132g/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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