| CAS Number | 1393683-77-6 |
| Catalog Number | AG001AVH(AGN-PC-0WAY20) |
| Chemical Name | Borate(1-), trifluoro(3-formyl-4-methoxyphenyl)-, potassium (1:1), (T-4)- |
| IUPAC Name | potassium;trifluoro-(3-formyl-4-methoxyphenyl)boranuide |
| InChI | InChI=1S/C8H7BF3O2.K/c1-14-8-3-2-7(9(10,11)12)4-6(8)5-13;/h2-5H,1H3;/q-1;+1 |
| InChI Key | GZTNAHZGXDZRMT-UHFFFAOYSA-N |
| MDL Number | MFCD09993570 |
| Molecular Formula | C8H7BF3KO2 |
| Molecular Weight | 242.0445 |
| SMILES | COC1=CC=C([B-](F)(F)F)C=C1C=O.[K+] |
| Synonyms | 1393683-77-6,
Potassium 3-formyl-4-methoxyphenyltrifluoroborate,
C8H7BF3KO2,
AMTB715,
KS-000022FN,
MFCD09993570,
AKOS016339809,
AS-2686,
Potassium trifluoro(3-formyl-4-methoxyphenyl)borate,
potassium trifluoro(3-formyl-4-methoxyphenyl)boranuide,
Borate(1-), trifluoro(3-formyl-4-methoxyphenyl)-, potassium (1:1), (T-4)-,
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| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.046g/mol |
| Monoisotopic Mass | 242.013g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^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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