Home Other Building Blocks 3-Fluoro-adaMantan-1-Methanol

3-Fluoro-adaMantan-1-Methanol

CAS No.:
106094-47-7
Catalog Number:
AG008TRP
Molecular Formula:
C11H17FO
Molecular Weight:
184.2505
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Product Description
Catalog Number:
AG008TRP
Chemical Name:
3-Fluoro-adaMantan-1-Methanol
CAS Number:
106094-47-7
Molecular Formula:
C11H17FO
Molecular Weight:
184.2505
MDL Number:
MFCD18800687
IUPAC Name:
(3-fluoro-1-adamantyl)methanol
InChI:
InChI=1S/C11H17FO/c12-11-4-8-1-9(5-11)3-10(2-8,6-11)7-13/h8-9,13H,1-7H2
InChI Key:
HSPPHIJMDJLXOW-UHFFFAOYSA-N
SMILES:
OCC12CC3CC(C1)CC(C2)(C3)F
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.254g/mol
Monoisotopic Mass:
184.126g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties