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1005077-74-6 | 2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 6-amino-, 1,1-dimethylethyl ester
CAS No: 1005077-74-6 Catalog No: AG00026O MDL No:MFCD09040750
Product Description
Catalog Number:
AG00026O
Chemical Name:
2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 6-amino-, 1,1-dimethylethyl ester
CAS Number:
1005077-74-6
Molecular Formula:
C11H20N2O2
Molecular Weight:
212.2887
MDL Number:
MFCD09040750
IUPAC Name:
tert-butyl 6-amino-2-azabicyclo[2.2.1]heptane-2-carboxylate
InChI:
InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-6-7-4-8(12)9(13)5-7/h7-9H,4-6,12H2,1-3H3
InChI Key:
WDLJVXLPYIOWOZ-UHFFFAOYSA-N
SMILES:
NC1CC2CC1N(C2)C(=O)OC(C)(C)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.152g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.293g/mol
Monoisotopic Mass:
212.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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