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1552265-55-0 | Cyclobutanecarboxylic acid, 3-fluoro-3-phenyl-
CAS No: 1552265-55-0 Catalog No: AG001NQT MDL No:
Product Description
Catalog Number:
AG001NQT
Chemical Name:
Cyclobutanecarboxylic acid, 3-fluoro-3-phenyl-
CAS Number:
1552265-55-0
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
IUPAC Name:
3-fluoro-3-phenylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C11H11FO2/c12-11(6-8(7-11)10(13)14)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,13,14)
InChI Key:
AZTVJZSDYNFHIM-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(C1)(F)c1ccccc1
Properties
Complexity:
227
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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