| CAS Number | 1559064-08-2 |
| Catalog Number | AG00J2TK(AGN-PC-0WB655) |
| Chemical Name | 6-bromo-3-fluoro-2-methylphenol |
| IUPAC Name | 6-bromo-3-fluoro-2-methylphenol |
| InChI | InChI=1S/C7H6BrFO/c1-4-6(9)3-2-5(8)7(4)10/h2-3,10H,1H3 |
| InChI Key | NJJWOIJACWVQSZ-UHFFFAOYSA-N |
| MDL Number | MFCD22414738 |
| Molecular Formula | C7H6BrFO |
| Molecular Weight | 205.0243 |
| SMILES | C1(C)C(F)=CC=C(Br)C=1O |
| Synonyms | 6-bromo-3-fluoro-2-methylphenol,
1559064-08-2,
SCHEMBL2051687,
ZX-CM010663,
MFCD22414738,
ZINC95929147,
AKOS027426493,
FCH1641563,
A-6940,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.959g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.026g/mol |
| Monoisotopic Mass | 203.959g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number