Home Carboxys Tricyclo[3.3.1.13,7]decane-1-carboxylicacid, 3-fluoro-

Tricyclo[3.3.1.13,7]decane-1-carboxylicacid, 3-fluoro-

CAS No.:
880-50-2
Catalog Number:
AG004FOX
Molecular Formula:
C11H15FO2
Molecular Weight:
198.2340
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Product Description
Catalog Number:
AG004FOX
Chemical Name:
Tricyclo[3.3.1.13,7]decane-1-carboxylicacid, 3-fluoro-
CAS Number:
880-50-2
Molecular Formula:
C11H15FO2
Molecular Weight:
198.2340
MDL Number:
MFCD00225706
IUPAC Name:
3-fluoroadamantane-1-carboxylic acid
InChI:
InChI=1S/C11H15FO2/c12-11-4-7-1-8(5-11)3-10(2-7,6-11)9(13)14/h7-8H,1-6H2,(H,13,14)
InChI Key:
SJULXDNAWKQQEV-UHFFFAOYSA-N
SMILES:
OC(=O)C12CC3CC(C1)CC(C2)(C3)F
NSC Number:
646340
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.237g/mol
Monoisotopic Mass:
198.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties