Home Carboxys 4-Aminobicyclo[2.2.2]octane-1-carboxylic acid

4-Aminobicyclo[2.2.2]octane-1-carboxylic acid

CAS No.:
13595-17-0
Catalog Number:
AG00723X
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$239
- +
250mg
95%
In Stock USA
United States
$461
- +
Product Description
Catalog Number:
AG00723X
Chemical Name:
4-Aminobicyclo[2.2.2]octane-1-carboxylic acid
CAS Number:
13595-17-0
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
MDL Number:
MFCD20640191
IUPAC Name:
4-aminobicyclo[2.2.2]octane-1-carboxylic acid
InChI:
InChI=1S/C9H15NO2/c10-9-4-1-8(2-5-9,3-6-9)7(11)12/h1-6,10H2,(H,11,12)
InChI Key:
ITNWSEKOBRDGLY-UHFFFAOYSA-N
SMILES:
OC(=O)C12CCC(CC1)(CC2)N
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.11g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
169.224g/mol
Monoisotopic Mass:
169.11g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.1  
Properties