Home Carboxys 8-Azabicyclo[3.2.1]octane-8-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester, (3-endo)-

8-Azabicyclo[3.2.1]octane-8-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester, (3-endo)-

CAS No.:
273376-39-9
Catalog Number:
AG00IKQ7
Molecular Formula:
C13H23NO3
Molecular Weight:
241.3266
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$410
- +
1g
97%
1 week
United States
$1153
- +
5g
97%
1 week
United States
$3371
- +
Product Description
Catalog Number:
AG00IKQ7
Chemical Name:
8-Azabicyclo[3.2.1]octane-8-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester, (3-endo)-
CAS Number:
273376-39-9
Molecular Formula:
C13H23NO3
Molecular Weight:
241.3266
MDL Number:
MFCD29037442
IUPAC Name:
tert-butyl (1R,5S)-3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate
InChI:
InChI=1S/C13H23NO3/c1-13(2,3)17-12(16)14-10-4-5-11(14)7-9(6-10)8-15/h9-11,15H,4-8H2,1-3H3/t9?,10-,11+
InChI Key:
WPHYDBXMMSEFTR-FGWVZKOKSA-N
SMILES:
OC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
241.168g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.331g/mol
Monoisotopic Mass:
241.168g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties