Home Other Building Blocks 1,1,1-trifluoro-3-(4-fluorophenyl)propan-2-ol

1,1,1-trifluoro-3-(4-fluorophenyl)propan-2-ol

CAS No.:
1344006-94-5
Catalog Number:
AG01AG9I
Molecular Formula:
C9H8F4O
Molecular Weight:
208.1528
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Product Description
Catalog Number:
AG01AG9I
Chemical Name:
1,1,1-trifluoro-3-(4-fluorophenyl)propan-2-ol
CAS Number:
1344006-94-5
Molecular Formula:
C9H8F4O
Molecular Weight:
208.1528
MDL Number:
MFCD16615970
IUPAC Name:
1,1,1-trifluoro-3-(4-fluorophenyl)propan-2-ol
InChI:
InChI=1S/C9H8F4O/c10-7-3-1-6(2-4-7)5-8(14)9(11,12)13/h1-4,8,14H,5H2
InChI Key:
NNHSNLBBGIBVDH-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)CC(C(F)(F)F)O
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.051g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.156g/mol
Monoisotopic Mass:
208.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties