Home Halogens 2-(3-bromophenyl)-1,1,1-trifluoropropan-2-ol

2-(3-bromophenyl)-1,1,1-trifluoropropan-2-ol

CAS No.:
122243-30-5
Catalog Number:
AG019T4H
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
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Product Description
Catalog Number:
AG019T4H
Chemical Name:
2-(3-bromophenyl)-1,1,1-trifluoropropan-2-ol
CAS Number:
122243-30-5
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
MDL Number:
MFCD16068003
IUPAC Name:
2-(3-bromophenyl)-1,1,1-trifluoropropan-2-ol
InChI:
InChI=1S/C9H8BrF3O/c1-8(14,9(11,12)13)6-3-2-4-7(10)5-6/h2-5,14H,1H3
InChI Key:
NSFHTONABRSTTQ-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C(C(F)(F)F)(O)C
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.971g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.061g/mol
Monoisotopic Mass:
267.971g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties