Home Other Building Blocks 5-Bromo-2-(trifluoromethyl)phenol

5-Bromo-2-(trifluoromethyl)phenol

CAS No.:
1121585-15-6
Catalog Number:
AG00394W
Molecular Formula:
C7H4BrF3O
Molecular Weight:
241.0053
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Product Description
Catalog Number:
AG00394W
Chemical Name:
5-Bromo-2-(trifluoromethyl)phenol
CAS Number:
1121585-15-6
Molecular Formula:
C7H4BrF3O
Molecular Weight:
241.0053
MDL Number:
MFCD07787469
IUPAC Name:
5-bromo-2-(trifluoromethyl)phenol
InChI:
InChI=1S/C7H4BrF3O/c8-4-1-2-5(6(12)3-4)7(9,10)11/h1-3,12H
InChI Key:
XJAPJZDTGAPNOD-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)O)C(F)(F)F
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.94g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.007g/mol
Monoisotopic Mass:
239.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties