| CAS Number | 89694-50-8 |
| Catalog Number | AG00GXFC(AGN-PC-0WALZR) |
| Chemical Name | (2-Iodo-5-methoxyphenyl)boronic acid |
| IUPAC Name | (2-iodo-5-methoxyphenyl)boronic acid |
| InChI | InChI=1S/C7H8BIO3/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,10-11H,1H3 |
| InChI Key | XQYAEIDOJUNIGY-UHFFFAOYSA-N |
| MDL Number | MFCD26793796 |
| Molecular Formula | C7H8BIO3 |
| Molecular Weight | 277.8521 |
| SMILES | COC1=CC=C(I)C(B(O)O)=C1 |
| Synonyms | (2-iodo-5-methoxyphenyl)boronic acid,
89694-50-8,
2-Iodo-5-methoxyphenylboronic acid,
C7H8BIO3,
AMTB744,
SCHEMBL9935773,
MIBA, 96%,
XQYAEIDOJUNIGY-UHFFFAOYSA-N,
5-Methoxy-2-iodophenylboronic acid,
2380AF,
MFCD26793796,
AKOS025392343,
ZINC169998102,
AS-2728,
FCH2484563,
KS-000022G9,
OR310361,
FT-0700049,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.961g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.852g/mol |
| Monoisotopic Mass | 277.961g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number