| CAS Number | 2017555-09-6 |
| Catalog Number | AG00I3RV(AGN-PC-0WCD3J) |
| Chemical Name | Potassium 4-(furfurylaminocarbonyl)phenyltrifluoroborate |
| IUPAC Name | potassium;trifluoro-[4-(furan-2-ylmethylcarbamoyl)phenyl]boranuide |
| InChI | InChI=1S/C12H10BF3NO2.K/c14-13(15,16)10-5-3-9(4-6-10)12(18)17-8-11-2-1-7-19-11;/h1-7H,8H2,(H,17,18);/q-1;+1 |
| InChI Key | BNXMQAULUCBEPA-UHFFFAOYSA-N |
| MDL Number | MFCD11977716 |
| Molecular Formula | C12H10BF3KNO2 |
| Molecular Weight | 307.1178 |
| SMILES | [K+].F[B-](F)(F)C2(=CC=C(C(=O)NCC=1(OC=CC=1))C=C2) |
| Synonyms | MFCD11977716,
2017555-09-6,
Potassium 4-(furfurylaminocarbonyl)phenyltrifluoroborate,
Potassium [4-(furfurylamino-1-carbonyl)phenyl]trifluoroborate,
potassium trifluoro(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)boranuide,
AMTB164,
ZX-RL002810,
AKOS025392291,
AS-2384,
KS-000022B4,
PC200142,
M-3763,
Potassium [4-(furfurylamino-1-carbonyl)-phenyl]trifluoroborate,
C12H10BF3NO2.K,
|
| Complexity | 322 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 307.039g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 307.121g/mol |
| Monoisotopic Mass | 307.039g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number