Home Other Building Blocks 2-methyl-1-[4-(trifluoromethyl)phenyl]propan-1-ol

2-methyl-1-[4-(trifluoromethyl)phenyl]propan-1-ol

CAS No.:
116707-07-4
Catalog Number:
AG01A1N9
Molecular Formula:
C11H13F3O
Molecular Weight:
218.2155
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Product Description
Catalog Number:
AG01A1N9
Chemical Name:
2-methyl-1-[4-(trifluoromethyl)phenyl]propan-1-ol
CAS Number:
116707-07-4
Molecular Formula:
C11H13F3O
Molecular Weight:
218.2155
MDL Number:
MFCD16310043
IUPAC Name:
2-methyl-1-[4-(trifluoromethyl)phenyl]propan-1-ol
InChI:
InChI=1S/C11H13F3O/c1-7(2)10(15)8-3-5-9(6-4-8)11(12,13)14/h3-7,10,15H,1-2H3
InChI Key:
YNQTYYXTRWBZJT-UHFFFAOYSA-N
SMILES:
OC(c1ccc(cc1)C(F)(F)F)C(C)C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.092g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.219g/mol
Monoisotopic Mass:
218.092g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties