| CAS Number | 55984-17-3 |
| Catalog Number | AG00DLTY(AGN-PC-002YX4) |
| Chemical Name | 2-chloro-1-(furan-2-yl)ethan-1-one |
| IUPAC Name | 2-chloro-1-(furan-2-yl)ethanone |
| InChI | InChI=1S/C6H5ClO2/c7-4-5(8)6-2-1-3-9-6/h1-3H,4H2 |
| InChI Key | IUFPPSVVHJDWAL-UHFFFAOYSA-N |
| MDL Number | MFCD11934329 |
| Molecular Formula | C6H5ClO2 |
| Molecular Weight | 144.5557 |
| SMILES | ClCC(C1OC=CC=1)=O |
| Synonyms | 2-chloro-1-(furan-2-yl)ethan-1-one,
55984-17-3,
2-chloro-1-(2-furyl)ethanone,
Ethanone, 2-chloro-1-(2-furanyl)- (9CI),
chloroacetylfuran,
2-chloroacetyl furan,
SCHEMBL1180379,
1-(2-Furyl)-2-chloroethanone,
IUFPPSVVHJDWAL-UHFFFAOYSA-N,
2-chloro-1-(furan-2-yl)-ethanone,
ZINC32005474,
AKOS006386906,
FT-0753148,
I14-22208,
F8884-5392,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.998g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.554g/mol |
| Monoisotopic Mass | 143.998g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 30.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number