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

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

CAS No.:
78385-84-9
Catalog Number:
AG00GH1R
Molecular Formula:
C9H13FO2
Molecular Weight:
172.1967
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$142
- +
250mg
97%
1 week
United States
$210
- +
1g
97%
1 week
United States
$545
- +
Product Description
Catalog Number:
AG00GH1R
Chemical Name:
4-Fluorobicyclo[2.2.2]octane-1-carboxylic acid
CAS Number:
78385-84-9
Molecular Formula:
C9H13FO2
Molecular Weight:
172.1967
MDL Number:
MFCD20638766
IUPAC Name:
4-fluorobicyclo[2.2.2]octane-1-carboxylic acid
InChI:
InChI=1S/C9H13FO2/c10-9-4-1-8(2-5-9,3-6-9)7(11)12/h1-6H2,(H,11,12)
InChI Key:
CCOTVPAWNHYJSJ-UHFFFAOYSA-N
SMILES:
OC(=O)C12CCC(CC1)(CC2)F
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.199g/mol
Monoisotopic Mass:
172.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties