| CAS Number | 1427358-60-8 |
| Catalog Number | AG00HWKT(AGN-PC-0WOV1Z) |
| Chemical Name | 1-oxa-6-azaspiro[3.3]heptane, oxalic acid |
| IUPAC Name | 1-oxa-6-azaspiro[3.3]heptane;oxalic acid |
| InChI | InChI=1S/C5H9NO.C2H2O4/c1-2-7-5(1)3-6-4-5;3-1(4)2(5)6/h6H,1-4H2;(H,3,4)(H,5,6) |
| InChI Key | HEQQLMIYMDQAPT-UHFFFAOYSA-N |
| MDL Number | MFCD17214340 |
| Molecular Formula | C7H11NO5 |
| Molecular Weight | 189.1659 |
| SMILES | C(C(=O)O)(=O)O.O1CCC12CNC2 |
| Synonyms | 1-OXA-6-AZASPIRO[3.3]HEPTANE OXALATE,
1427358-60-8,
SCHEMBL16415168,
HEQQLMIYMDQAPT-UHFFFAOYSA-N,
MFCD17214340,
AKOS024258611,
PB19580,
AS-32751,
SC-70250,
SY131088,
1-oxa-6-azaspiro[3.3]heptane ethanedioate,
1-oxa-6-azaspiro[3.3]heptane oxalic acid,
ST1020067,
1-oxa-6-azaspiro[3.3]heptane; oxalic acid,
MFCD17214340 (95%),
1-Oxa-6-azaspiro[3,3]heptane oxalate (1:1) salt,
936947-34-1,
1-oxa-6-azaspiro[3,3]heptane hydrochloride,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.167g/mol |
| Monoisotopic Mass | 189.064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 95.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number