| CAS Number | 1429874-11-2 |
| Catalog Number | AG01BHSA(AGN-PC-0WNNY9) |
| Chemical Name | (2-methoxy-6-(trifluoromethyl)pyridin-3-yl)boronic acid |
| IUPAC Name | [2-methoxy-6-(trifluoromethyl)pyridin-3-yl]boronic acid |
| InChI | InChI=1S/C7H7BF3NO3/c1-15-6-4(8(13)14)2-3-5(12-6)7(9,10)11/h2-3,13-14H,1H3 |
| InChI Key | RBIFHAWLTLCJFB-UHFFFAOYSA-N |
| MDL Number | MFCD10696221 |
| Molecular Formula | C7H7BF3NO3 |
| Molecular Weight | 220.9416 |
| SMILES | FC(C1=CC=C(B(O)O)C(OC)=N1)(F)F |
| Synonyms | 1429874-11-2,
(2-methoxy-6-(trifluoromethyl)pyridin-3-yl)boronic acid,
2-METHOXY-6-(TRIFLUOROMETHYL)PYRIDINE-3-BORONIC ACID,
[2-methoxy-6-(trifluoromethyl)pyridin-3-yl]boronic acid,
SCHEMBL14844546,
RBIFHAWLTLCJFB-UHFFFAOYSA-N,
MFCD10696221,
AKOS025286627,
ZINC206042794,
AB56792,
AM86593,
AS-49578,
SC-51768,
[2-methoxy-6-(trifluoromethyl)-3-pyridyl]boronic acid,
2-METHOXY-6-(TRIFLUOROMETHYL)PYRIDINE-3-BORONIC AC,
2-METHOXY-6-TRIFLUOROMETHYLPYRIDIN-3-BORONIC ACID,
2-METHOXY-6-(TRIFLUOROMETHYL)PYRIDIN-3-YLBORONIC ACID,
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| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.942g/mol |
| Monoisotopic Mass | 221.047g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 62.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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