Home Carboxys Rel-(1r,5s,7s)-6-tert-butyl 7-ethyl 3,6-diazabicyclo[3.2.1]octane-6,7-dicarboxylate

Rel-(1r,5s,7s)-6-tert-butyl 7-ethyl 3,6-diazabicyclo[3.2.1]octane-6,7-dicarboxylate

CAS No.:
1251012-84-6
Catalog Number:
AG00HI1N
Molecular Formula:
C14H24N2O4
Molecular Weight:
284.3514
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$387
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Product Description
Catalog Number:
AG00HI1N
Chemical Name:
Rel-(1r,5s,7s)-6-tert-butyl 7-ethyl 3,6-diazabicyclo[3.2.1]octane-6,7-dicarboxylate
CAS Number:
1251012-84-6
Molecular Formula:
C14H24N2O4
Molecular Weight:
284.3514
MDL Number:
MFCD22370077
IUPAC Name:
6-O-tert-butyl 7-O-ethyl 3,6-diazabicyclo[3.2.1]octane-6,7-dicarboxylate
InChI:
InChI=1S/C14H24N2O4/c1-5-19-12(17)11-9-6-10(8-15-7-9)16(11)13(18)20-14(2,3)4/h9-11,15H,5-8H2,1-4H3
InChI Key:
IMALXXQBKVAKSL-UHFFFAOYSA-N
SMILES:
CCOC(=O)[C@@H]1[C@H]2CNC[C@H](N1C(=O)OC(C)(C)C)C2
Properties
Complexity:
391  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.174g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.356g/mol
Monoisotopic Mass:
284.174g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties