| CAS Number | 242133-59-1 |
| Catalog Number | AG01AQML(AGN-PC-03U0XL) |
| Chemical Name | 7-Methoxy-1-benzofuran-2-carbonyl chloride |
| IUPAC Name | 7-methoxy-1-benzofuran-2-carbonyl chloride |
| InChI | InChI=1S/C10H7ClO3/c1-13-7-4-2-3-6-5-8(10(11)12)14-9(6)7/h2-5H,1H3 |
| InChI Key | CESLGDUYYAIOPZ-UHFFFAOYSA-N |
| MDL Number | MFCD16652920 |
| Molecular Formula | C10H7ClO3 |
| Molecular Weight | 210.6138 |
| SMILES | COC1=C2C(C=C(C(Cl)=O)O2)=CC=C1 |
| Synonyms | 7-methoxy-1-benzofuran-2-carbonyl chloride,
242133-59-1,
2-Benzofurancarbonyl chloride, 7-methoxy-,
SCHEMBL3614366,
CESLGDUYYAIOPZ-UHFFFAOYSA-N,
ZINC48980990,
AKOS015957882,
7-methoxybenzofuran-2-carbonyl chloride,
F2145-0105,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.008g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.613g/mol |
| Monoisotopic Mass | 210.008g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number