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1153767-91-9 | 1,8-Diazaspiro[4.5]decane-1-carboxylic acid, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS No: 1153767-91-9 Catalog No: AG000GNH MDL No:MFCD13185077
Product Description
Catalog Number:
AG000GNH
Chemical Name:
1,8-Diazaspiro[4.5]decane-1-carboxylic acid, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS Number:
1153767-91-9
Molecular Formula:
C13H25ClN2O2
Molecular Weight:
276.8028
MDL Number:
MFCD13185077
IUPAC Name:
tert-butyl 1,8-diazaspiro[4.5]decane-1-carboxylate;hydrochloride
InChI:
InChI=1S/C13H24N2O2.ClH/c1-12(2,3)17-11(16)15-10-4-5-13(15)6-8-14-9-7-13;/h14H,4-10H2,1-3H3;1H
InChI Key:
RDKNFQFBKPYPKJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC21CCNCC2)OC(C)(C)C.Cl
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.16g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.805g/mol
Monoisotopic Mass:
276.16g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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