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146038-53-1 | Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-fluoro-
CAS No: 146038-53-1 Catalog No: AG001DMC MDL No:MFCD19228680
Product Description
Catalog Number:
AG001DMC
Chemical Name:
Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-fluoro-
CAS Number:
146038-53-1
Molecular Formula:
C6H7FO2
Molecular Weight:
130.1170
MDL Number:
MFCD19228680
IUPAC Name:
3-fluorobicyclo[1.1.1]pentane-1-carboxylic acid
InChI:
InChI=1S/C6H7FO2/c7-6-1-5(2-6,3-6)4(8)9/h1-3H2,(H,8,9)
InChI Key:
CQOUAQUBJPKQON-UHFFFAOYSA-N
SMILES:
OC(=O)C12CC(C1)(C2)F
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
130.118g/mol
Monoisotopic Mass:
130.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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