Home Other Building Blocks 4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol

4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol

CAS No.:
179632-68-9
Catalog Number:
AG019ZKC
Molecular Formula:
C9H9F3O2
Molecular Weight:
206.1618
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Product Description
Catalog Number:
AG019ZKC
Chemical Name:
4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol
CAS Number:
179632-68-9
Molecular Formula:
C9H9F3O2
Molecular Weight:
206.1618
MDL Number:
MFCD16068012
IUPAC Name:
4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol
InChI:
InChI=1S/C9H9F3O2/c1-8(14,9(10,11)12)6-2-4-7(13)5-3-6/h2-5,13-14H,1H3
InChI Key:
WNKAWMMGLNHYRT-UHFFFAOYSA-N
SMILES:
CC(C(F)(F)F)(c1ccc(cc1)O)O
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.055g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.164g/mol
Monoisotopic Mass:
206.055g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties