| CAS Number | 1385696-68-3 |
| Catalog Number | AG0018R4(AGN-PC-0WA4HX) |
| Chemical Name | 1,8-Diazaspiro[4.5]decane-1-carboxylic acid, phenylmethyl ester, hydrochloride (1:1) |
| IUPAC Name | benzyl 1,8-diazaspiro[4.5]decane-1-carboxylate;hydrochloride |
| InChI | InChI=1S/C16H22N2O2.ClH/c19-15(20-13-14-5-2-1-3-6-14)18-12-4-7-16(18)8-10-17-11-9-16;/h1-3,5-6,17H,4,7-13H2;1H |
| InChI Key | FIQZCNCKMGHANL-UHFFFAOYSA-N |
| MDL Number | MFCD20809860 |
| Molecular Formula | C16H23ClN2O2 |
| Molecular Weight | 310.8190 |
| SMILES | Cl.O=C(OCC1=CC=CC=C1)N1CCCC11CCNCC1 |
| Synonyms | 1385696-68-3,
BENZYL 1,8-DIAZASPIRO[4.5]DECANE-1-CARBOXYLATE HYDROCHLORIDE,
1-CBZ-1,8-DIAZASPIRO[4.5]DECANE HYDROCHLORIDE,
1-Cbz-1,8-diazaspiro[4.5]decane HCl,
MFCD20809860,
AKOS025290126,
PB28826,
AK172243,
AS-34466,
CS-0049875,
KS-00000701,
Q-2867,
Benzyl 4,8-diazaspiro[4.5]decane-4-carboxylate hydrochloride,
1,8-Diazaspiro[4.5]decane-1-carboxylic acid, phenylmethyl ester, hydrochloride (1:1),
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| Complexity | 333 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 310.145g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 310.822g/mol |
| Monoisotopic Mass | 310.145g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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