| CAS Number | 365426-92-2 |
| Catalog Number | AG00I78L(AGN-PC-0061ZT) |
| Chemical Name | 3-(3-Trifluoromethylphenyl)phenol |
| IUPAC Name | 3-[3-(trifluoromethyl)phenyl]phenol |
| InChI | InChI=1S/C13H9F3O/c14-13(15,16)11-5-1-3-9(7-11)10-4-2-6-12(17)8-10/h1-8,17H |
| InChI Key | YLPOORUJYGDZAC-UHFFFAOYSA-N |
| MDL Number | MFCD06802316 |
| Molecular Formula | C13H9F3O |
| Molecular Weight | 238.2052 |
| SMILES | C(F)(F)(C1=CC(=CC=C1)C1C=CC=C(O)C=1)F |
| Synonyms | 365426-92-2,
3-(3-Trifluoromethylphenyl)phenol,
3'-(Trifluoromethyl)[1,1'-biphenyl]-3-ol,
3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-ol,
SCHEMBL1029849,
DTXSID40461297,
MFCD06802316,
ZINC16946996,
AKOS002678207,
BB 0223379,
[1,1'-Biphenyl]-3-ol, 3'-(trifluoromethyl)-,
3-[3-(trifluoromethyl)phenyl]phenol,
CID11287852,
|
| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.209g/mol |
| Monoisotopic Mass | 238.061g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number