| CAS Number | 1404115-38-3 |
| Catalog Number | AG01FHA1(AGN-PC-3H4ANE) |
| Chemical Name | 2-Bromo-3,6-difluorobenzyl alcohol |
| IUPAC Name | (2-bromo-3,6-difluorophenyl)methanol |
| InChI | InChI=1S/C7H5BrF2O/c8-7-4(3-11)5(9)1-2-6(7)10/h1-2,11H,3H2 |
| InChI Key | JSEQBLCGRWMEKX-UHFFFAOYSA-N |
| MDL Number | MFCD28061449 |
| Molecular Formula | C7H5BrF2O |
| Molecular Weight | 223.0148 |
| SMILES | BrC1=C(C(=CC=C1F)F)CO |
| Synonyms | 2-Bromo-3,6-difluorobenzyl alcohol,
1404115-38-3,
SCHEMBL16825606,
MFCD28061449,
(2-bromo-3,6-difluorophenyl)methanol,
ZINC238708163,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.949g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.017g/mol |
| Monoisotopic Mass | 221.949g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number