| CAS Number | 1630906-43-2 |
| Catalog Number | AG001TP8(AGN-PC-0WBSSG) |
| Chemical Name | 7-Oxa-2-azaspiro[4.5]decane, ethanedioate (2:1) |
| IUPAC Name | 7-oxa-2-azaspiro[4.5]decane;oxalic acid |
| InChI | InChI=1S/2C8H15NO.C2H2O4/c2*1-2-8(7-10-5-1)3-4-9-6-8;3-1(4)2(5)6/h2*9H,1-7H2;(H,3,4)(H,5,6) |
| InChI Key | GHDPJNVTRYZODS-UHFFFAOYSA-N |
| MDL Number | MFCD28166296 |
| Molecular Formula | C18H32N2O6 |
| Molecular Weight | 372.4565 |
| SMILES | C(C(=O)O)(=O)O.C1NCCC12COCCC2.C2NCCC21COCCC1 |
| Synonyms | 1630906-43-2,
7-Oxa-2-azaspiro[4.5]decane oxalate(2:1),
7-oxa-2-azaspiro[4.5]decane hemioxalate,
7-Oxa-2-aza-spiro[4.5]decane hemioxalate,
KS-000008AW,
MFCD28166296,
AKOS025289945,
SB21634,
AK171859,
AS-52210,
9-Oxa-3-azaspiro[4.5]decane; oxalic acid,
CS-0049990,
7-Oxa-2-azaspiro[4.5]decane, ethanedioate (2:1),
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| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 372.226g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 372.462g/mol |
| Monoisotopic Mass | 372.226g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 117A^2 |
| Undefined Atom Stereocenter Count | 2 |
| 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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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number