Home Carboxys Trans-3-fluoro-3-methylcyclobutane-1-carboxylic acid

Trans-3-fluoro-3-methylcyclobutane-1-carboxylic acid

CAS No.:
1455037-43-0
Catalog Number:
AG001D4M
Molecular Formula:
C6H9FO2
Molecular Weight:
132.1329
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Product Description
Catalog Number:
AG001D4M
Chemical Name:
Trans-3-fluoro-3-methylcyclobutane-1-carboxylic acid
CAS Number:
1455037-43-0
Molecular Formula:
C6H9FO2
Molecular Weight:
132.1329
MDL Number:
MFCD28969665
IUPAC Name:
3-fluoro-3-methylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C6H9FO2/c1-6(7)2-4(3-6)5(8)9/h4H,2-3H2,1H3,(H,8,9)
InChI Key:
ZABOQQDLGWHBIE-UHFFFAOYSA-N
SMILES:
OC(=O)[C@@H]1C[C@@](C1)(C)F
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.059g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
132.134g/mol
Monoisotopic Mass:
132.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties