| CAS Number | 1160247-18-6 |
| Catalog Number | AG000BF9(AGN-PC-0WCK9Y) |
| Chemical Name | tert-butyl 3-(aminomethyl)-1-oxa-7-azaspiro[4.5]decane-7-carboxylate |
| IUPAC Name | tert-butyl 3-(aminomethyl)-1-oxa-9-azaspiro[4.5]decane-9-carboxylate |
| InChI | InChI=1S/C14H26N2O3/c1-13(2,3)19-12(17)16-6-4-5-14(10-16)7-11(8-15)9-18-14/h11H,4-10,15H2,1-3H3 |
| InChI Key | CYIJGWKOFZHWLD-UHFFFAOYSA-N |
| MDL Number | MFCD12198562 |
| Molecular Formula | C14H26N2O3 |
| Molecular Weight | 270.3678 |
| SMILES | CC(C)(C)OC(=O)N1CCCC2(CC(CN)CO2)C1 |
| Synonyms | 1160247-18-6,
TERT-BUTYL 3-(AMINOMETHYL)-1-OXA-7-AZASPIRO[4.5]DECANE-7-CARBOXYLATE,
KS-000003ZI,
MFCD12198562,
PB16498,
1-OXA-7-AZASPIRO[4.5]DECANE-7-CARBOXYLIC ACID, 3-(AMINOMETHYL)-, 1,1-DIMETHYLETHYL ESTER,
AK170754,
AM805295,
AS-33810,
CS-0000766,
7-Boc-1-oxa-7-azaspiro[4.5]decane-3-methanamine,
tert-butyl 3-(aminomethyl)-1-oxa-9-azaspiro[4.5]decane-9-carboxylate,
tert-Butyl3-(aminomethyl)-1-oxa-7-azaspiro[4.5]decane-7-carboxylate,
1-Oxa-7-azaspiro[4.5]decane-7-carboxylic acid,3-(aminomethyl)-,1,1-dimethylethyl ester,
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| Complexity | 340 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.373g/mol |
| Monoisotopic Mass | 270.194g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 64.8A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
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