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1233323-55-1 | 6-Azaspiro[2.5]octane-6-carboxylic acid, 1-amino-, 1,1-dimethylethyl ester
CAS No: 1233323-55-1 Catalog No: AG000KCO MDL No:MFCD28023497
Product Description
Catalog Number:
AG000KCO
Chemical Name:
6-Azaspiro[2.5]octane-6-carboxylic acid, 1-amino-, 1,1-dimethylethyl ester
CAS Number:
1233323-55-1
Molecular Formula:
C12H22N2O2
Molecular Weight:
226.3153
MDL Number:
MFCD28023497
IUPAC Name:
tert-butyl 2-amino-6-azaspiro[2.5]octane-6-carboxylate
InChI:
InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-6-4-12(5-7-14)8-9(12)13/h9H,4-8,13H2,1-3H3
InChI Key:
QZRDFJCRLZNCPN-UHFFFAOYSA-N
SMILES:
NC1CC21CCN(CC2)C(=O)OC(C)(C)C
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.168g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.32g/mol
Monoisotopic Mass:
226.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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