Home Carboxys Rel-(1s,3s,4r,6s)-2-(tert-butoxycarbonyl)-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carboxylic acid

Rel-(1s,3s,4r,6s)-2-(tert-butoxycarbonyl)-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carboxylic acid

CAS No.:
1250884-25-3
Catalog Number:
AG00HHW9
Molecular Formula:
C12H19NO5
Molecular Weight:
257.2830
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$483
- +
250mg
95%
In Stock USA
United States
$903
- +
1g
95%
In Stock USA
United States
$1806
- +
Product Description
Catalog Number:
AG00HHW9
Chemical Name:
Rel-(1s,3s,4r,6s)-2-(tert-butoxycarbonyl)-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carboxylic acid
CAS Number:
1250884-25-3
Molecular Formula:
C12H19NO5
Molecular Weight:
257.2830
MDL Number:
MFCD19442357
IUPAC Name:
6-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[2.2.1]heptane-3-carboxylic acid
InChI:
InChI=1S/C12H19NO5/c1-12(2,3)18-11(17)13-7-4-6(5-8(7)14)9(13)10(15)16/h6-9,14H,4-5H2,1-3H3,(H,15,16)
InChI Key:
ARWLIMOJIMFGRX-UHFFFAOYSA-N
SMILES:
O[C@H]1CC2CC1N([C@@H]2C(=O)O)C(=O)OC(C)(C)C
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.126g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.286g/mol
Monoisotopic Mass:
257.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties