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1160247-05-1 | 1-Oxa-4,8-diazaspiro[5.5]undecane-8-carboxylic acid, 1,1-dimethylethyl ester
CAS No: 1160247-05-1 Catalog No: AG000BFE MDL No:MFCD11227062
Product Description
Catalog Number:
AG000BFE
Chemical Name:
1-Oxa-4,8-diazaspiro[5.5]undecane-8-carboxylic acid, 1,1-dimethylethyl ester
CAS Number:
1160247-05-1
Molecular Formula:
C13H24N2O3
Molecular Weight:
256.3413
MDL Number:
MFCD11227062
IUPAC Name:
tert-butyl 1-oxa-4,8-diazaspiro[5.5]undecane-8-carboxylate
InChI:
InChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-7-4-5-13(10-15)9-14-6-8-17-13/h14H,4-10H2,1-3H3
InChI Key:
KSLJZAAAQPGVRM-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC2(C1)CNCCO2)OC(C)(C)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.179g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.346g/mol
Monoisotopic Mass:
256.179g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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