Home Carboxys 2-(4-fluorophenyl)cyclobutane-1-carboxylic acid, Mixture of diastereomers

2-(4-fluorophenyl)cyclobutane-1-carboxylic acid, Mixture of diastereomers

CAS No.:
1499764-95-2
Catalog Number:
AG01BV6A
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
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Product Description
Catalog Number:
AG01BV6A
Chemical Name:
2-(4-fluorophenyl)cyclobutane-1-carboxylic acid, Mixture of diastereomers
CAS Number:
1499764-95-2
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
MDL Number:
MFCD24024516
IUPAC Name:
2-(4-fluorophenyl)cyclobutane-1-carboxylic acid
InChI:
InChI=1S/C11H11FO2/c12-8-3-1-7(2-4-8)9-5-6-10(9)11(13)14/h1-4,9-10H,5-6H2,(H,13,14)
InChI Key:
MABRDUWQBLUQEV-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC1c1ccc(cc1)F
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.074g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.205g/mol
Monoisotopic Mass:
194.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties