| CAS Number | 431942-67-5 |
| Catalog Number | AG00DIWA(AGN-PC-07XTY6) |
| Chemical Name | 2,4-Dichloro-5-methoxyphenylboronic acid |
| IUPAC Name | (2,4-dichloro-5-methoxyphenyl)boronic acid |
| InChI | InChI=1S/C7H7BCl2O3/c1-13-7-2-4(8(11)12)5(9)3-6(7)10/h2-3,11-12H,1H3 |
| InChI Key | RNRFSHDFAVUELD-UHFFFAOYSA-N |
| MDL Number | MFCD12546454 |
| Molecular Formula | C7H7BCl2O3 |
| Molecular Weight | 220.8457 |
| SMILES | COC1=C(Cl)C=C(Cl)C(B(O)O)=C1 |
| Synonyms | 431942-67-5,
2,4-DICHLORO-5-METHOXYPHENYLBORONIC ACID,
(2,4-Dichloro-5-methoxyphenyl)boronic acid,
ACMC-209jtg,
SCHEMBL3576560,
CTK4I7158,
DTXSID40674562,
RNRFSHDFAVUELD-UHFFFAOYSA-N,
ANW-29954,
AKOS015849917,
ZINC169904018,
FCH1367226,
OR361110,
AX8280840,
TR-036796,
X0800,
B-2668,
I04-2461,
C7H7BCl2O3,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.987g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.84g/mol |
| Monoisotopic Mass | 219.987g/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
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Certificate of Analysis
Lot Number