| CAS Number | 577-10-6 |
| Catalog Number | AG00EZI8(AGN-PC-0NG5M5) |
| Chemical Name | 2,5-Dihydroxybenzotrifluoride |
| IUPAC Name | 2-(trifluoromethyl)benzene-1,4-diol |
| InChI | InChI=1S/C7H5F3O2/c8-7(9,10)5-3-4(11)1-2-6(5)12/h1-3,11-12H |
| InChI Key | GTXDKCFFLZJGRZ-UHFFFAOYSA-N |
| MDL Number | MFCD18395729 |
| Molecular Formula | C7H5F3O2 |
| Molecular Weight | 178.1086 |
| SMILES | Oc1ccc(c(c1)C(F)(F)F)O |
| Synonyms | 577-10-6,
2-(trifluoromethyl)benzene-1,4-diol,
2-trifluoromethylhydroquinone,
2-(Trifluoromethyl)hydroquinone,
1,4-Benzenediol, 2-(trifluoromethyl)-,
trifluoromethylhydroquinone,
2,5-Dihydroxybenzotrifluoride,
SCHEMBL5511642,
CTK1F1461,
DTXSID30455746,
GTXDKCFFLZJGRZ-UHFFFAOYSA-N,
ZINC38266010,
AKOS024058223,
VZ23372,
2- hydroquinone,
CID11116606,
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| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.024g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.11g/mol |
| Monoisotopic Mass | 178.024g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number