Home Carboxys 3-Phenylbicyclo[1.1.1]pentane-1-carboxylic acid

3-Phenylbicyclo[1.1.1]pentane-1-carboxylic acid

CAS No.:
83249-04-1
Catalog Number:
AG00GK2C
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$328
- +
250mg
95%
In Stock USA
United States
$546
- +
Product Description
Catalog Number:
AG00GK2C
Chemical Name:
3-Phenylbicyclo[1.1.1]pentane-1-carboxylic acid
CAS Number:
83249-04-1
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
MDL Number:
MFCD00101889
IUPAC Name:
3-phenylbicyclo[1.1.1]pentane-1-carboxylic acid
InChI:
InChI=1S/C12H12O2/c13-10(14)12-6-11(7-12,8-12)9-4-2-1-3-5-9/h1-5H,6-8H2,(H,13,14)
InChI Key:
MVSLMXUOSHYKID-UHFFFAOYSA-N
SMILES:
OC(=O)C12CC(C1)(C2)c1ccccc1
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.084g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties