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1160247-04-0 | 4-Oxa-1,9-diazaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester
CAS No: 1160247-04-0 Catalog No: AG000BE7 MDL No:MFCD12198543
Product Description
Catalog Number:
AG000BE7
Chemical Name:
4-Oxa-1,9-diazaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester
CAS Number:
1160247-04-0
Molecular Formula:
C13H24N2O3
Molecular Weight:
256.3413
MDL Number:
MFCD12198543
IUPAC Name:
tert-butyl 4-oxa-1,9-diazaspiro[5.5]undecane-9-carboxylate
InChI:
InChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-7-4-13(5-8-15)10-17-9-6-14-13/h14H,4-10H2,1-3H3
InChI Key:
JDCXGSPMQUVCTJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(CC1)NCCOC2)OC(C)(C)C
Properties
Complexity:
304
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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