| CAS Number | 1523571-04-1 |
| Catalog Number | AG00IL69(AGN-PC-0WCXEC) |
| Chemical Name | 7-Oxa-2-azaspiro[3.5]nonane oxalate(2:1) |
| IUPAC Name | 7-oxa-2-azaspiro[3.5]nonane;oxalic acid |
| InChI | InChI=1S/2C7H13NO.C2H2O4/c2*1-3-9-4-2-7(1)5-8-6-7;3-1(4)2(5)6/h2*8H,1-6H2;(H,3,4)(H,5,6) |
| InChI Key | DWJWLMVIJBWYFP-UHFFFAOYSA-N |
| MDL Number | MFCD22422285 |
| Molecular Formula | C16H28N2O6 |
| Molecular Weight | 344.4033 |
| SMILES | C(C(=O)O)(=O)O.C1NCC12CCOCC2.C2NCC21CCOCC1 |
| Synonyms | 7-oxa-2-azaspiro[3.5]nonane hemioxalate,
7-Oxa-2-azaspiro[3.5]nonane oxalate(2:1),
1523571-04-1,
1408076-09-4,
AK171865,
KS-000008CM,
MFCD22422285,
AKOS025289947,
SB21653,
AS-34906,
OR317239,
bis(7-oxa-2-azaspiro[3.5]nonane) oxalate,
CS-0049991,
7-Oxa-2-azaspiro[3.5]nonane oxalate (2:1),
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 344.195g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 344.408g/mol |
| Monoisotopic Mass | 344.195g/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
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number