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1239589-52-6 | Carbamic acid, N-(6-aminospiro[3.3]hept-2-yl)-, 1,1-dimethylethyl ester
CAS No: 1239589-52-6 Catalog No: AG000L9O MDL No:MFCD09054707
Product Description
Catalog Number:
AG000L9O
Chemical Name:
Carbamic acid, N-(6-aminospiro[3.3]hept-2-yl)-, 1,1-dimethylethyl ester
CAS Number:
1239589-52-6
Molecular Formula:
C12H22N2O2
Molecular Weight:
226.3153
MDL Number:
MFCD09054707
IUPAC Name:
tert-butyl N-(6-aminospiro[3.3]heptan-2-yl)carbamate
InChI:
InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-9-6-12(7-9)4-8(13)5-12/h8-9H,4-7,13H2,1-3H3,(H,14,15)
InChI Key:
XVXPJMGYUOYFOT-UHFFFAOYSA-N
SMILES:
NC1CC2(C1)CC(C2)NC(=O)OC(C)(C)C
Properties
Complexity:
282
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:
2
Isotope Atom Count:
0
Molecular Weight:
226.32g/mol
Monoisotopic Mass:
226.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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