| CAS Number | 1353878-13-3 |
| Catalog Number | AG00IWYR(AGN-PC-0WB0NY) |
| Chemical Name | (5-Bromo-3-iodo-2-methoxyphenyl)methanol |
| IUPAC Name | (5-bromo-3-iodo-2-methoxyphenyl)methanol |
| InChI | InChI=1S/C8H8BrIO2/c1-12-8-5(4-11)2-6(9)3-7(8)10/h2-3,11H,4H2,1H3 |
| InChI Key | PLRYQNRWSOKNMF-UHFFFAOYSA-N |
| MDL Number | MFCD00129459 |
| Molecular Formula | C8H8BrIO2 |
| Molecular Weight | 342.9564 |
| SMILES | IC1(=C(OC)C(=CC(=C1)[Br])CO) |
| Synonyms | (5-bromo-3-iodo-2-methoxyphenyl)methanol,
1353878-13-3,
bromoiodomethoxyphenylmethanol,
KS-000027DR,
ZX-RL003404,
MFCD20444430,
ZINC71789004,
AKOS015991506,
FCH1602830,
KF-0739,
MCULE-8669117995,
RP16811,
OR310120,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 341.875g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 342.958g/mol |
| Monoisotopic Mass | 341.875g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number