Home Halogens Benzenemethanol,4-chloro-a-methyl-3-(trifluoromethyl)-

Benzenemethanol,4-chloro-a-methyl-3-(trifluoromethyl)-

CAS No.:
348-84-5
Catalog Number:
AG007H4I
Molecular Formula:
C9H8ClF3O
Molecular Weight:
224.6074
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Product Description
Catalog Number:
AG007H4I
Chemical Name:
Benzenemethanol,4-chloro-a-methyl-3-(trifluoromethyl)-
CAS Number:
348-84-5
Molecular Formula:
C9H8ClF3O
Molecular Weight:
224.6074
MDL Number:
MFCD04973768
IUPAC Name:
1-[4-chloro-3-(trifluoromethyl)phenyl]ethanol
InChI:
InChI=1S/C9H8ClF3O/c1-5(14)6-2-3-8(10)7(4-6)9(11,12)13/h2-5,14H,1H3
InChI Key:
RMFUMJOARZCIFY-UHFFFAOYSA-N
SMILES:
CC(c1ccc(c(c1)C(F)(F)F)Cl)O
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.022g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.607g/mol
Monoisotopic Mass:
224.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties