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1367777-12-5 | 2-Oxa-5,8-diazaspiro[3.5]nonane-8-carboxylic acid, 1,1-dimethylethyl ester
CAS No: 1367777-12-5 Catalog No: AG0012BQ MDL No:MFCD22035557
Product Description
Catalog Number:
AG0012BQ
Chemical Name:
2-Oxa-5,8-diazaspiro[3.5]nonane-8-carboxylic acid, 1,1-dimethylethyl ester
CAS Number:
1367777-12-5
Molecular Formula:
C11H20N2O3
Molecular Weight:
228.2881
MDL Number:
MFCD22035557
IUPAC Name:
tert-butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate
InChI:
InChI=1S/C11H20N2O3/c1-10(2,3)16-9(14)13-5-4-12-11(6-13)7-15-8-11/h12H,4-8H2,1-3H3
InChI Key:
YUSLKABKYBSTRL-UHFFFAOYSA-N
SMILES:
O=C(N1CCNC2(C1)COC2)OC(C)(C)C
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.292g/mol
Monoisotopic Mass:
228.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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