| CAS Number | 1072946-24-7 |
| Catalog Number | AG003S5N(AGN-PC-0WAE6A) |
| Chemical Name | Monolithium 4-methoxypyridine-3-boronate |
| IUPAC Name | lithium;hydroxy-(4-methoxypyridin-3-yl)borinate |
| InChI | InChI=1S/C6H7BNO3.Li/c1-11-6-2-3-8-4-5(6)7(9)10;/h2-4,9H,1H3;/q-1;+1 |
| InChI Key | HPEJWXOXWXXSAQ-UHFFFAOYSA-N |
| MDL Number | MFCD10699631 |
| Molecular Formula | C6H7BLiNO3 |
| Molecular Weight | 158.8767 |
| SMILES | COc1ccncc1B(O)[O-].[Li+] |
| Synonyms | MONOLITHIUM 4-METHOXYPYRIDINE-3-BORONATE,
1072946-24-7,
C6H7BLiNO3,
ACMC-2098rp,
CTK4A5242,
DTXSID50674457,
ANW-15635,
AKOS006302753,
RTR-001568,
X1540,
A-4557,
Lithium hydrogen (4-methoxypyridin-3-yl)boronate,
I02-3457,
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| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.876g/mol |
| Monoisotopic Mass | 159.068g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 65.4A^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