| CAS Number | 1451392-22-5 |
| Catalog Number | AG00ARP7(AGN-PC-0WCRLH) |
| Chemical Name | 4-Methoxy-2-(methoxymethyl)phenylboronic acid |
| IUPAC Name | [4-methoxy-2-(methoxymethyl)phenyl]boronic acid |
| InChI | InChI=1S/C9H13BO4/c1-13-6-7-5-8(14-2)3-4-9(7)10(11)12/h3-5,11-12H,6H2,1-2H3 |
| InChI Key | FXLRYELPUQTVJS-UHFFFAOYSA-N |
| MDL Number | MFCD21187812 |
| Molecular Formula | C9H13BO4 |
| Molecular Weight | 196.0081 |
| SMILES | COCc1cc(OC)ccc1B(O)O |
| Synonyms | 4-Methoxy-2-(methoxymethyl)phenylboronic acid,
1451392-22-5,
(4-methoxy-2-(methoxymethyl)phenyl)boronic acid,
MFCD21187812,
AKOS014662769,
ZINC169986230,
AM86609,
BBV-39864527,
CS-0062023,
Z1527,
Q-8297,
C9H13BO4,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.009g/mol |
| Monoisotopic Mass | 196.091g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number