| CAS Number | 276235-91-7 |
| Catalog Number | AG002U9S(AGN-PC-0WAZ43) |
| Chemical Name | 2-Benzofuranmethanol, 5-fluoro- |
| IUPAC Name | (5-fluoro-1-benzofuran-2-yl)methanol |
| InChI | InChI=1S/C9H7FO2/c10-7-1-2-9-6(3-7)4-8(5-11)12-9/h1-4,11H,5H2 |
| InChI Key | VFXRFXAEZVQAHB-UHFFFAOYSA-N |
| MDL Number | MFCD09907889 |
| Molecular Formula | C9H7FO2 |
| Molecular Weight | 166.1491 |
| SMILES | OCC1=CC2=CC(F)=CC=C2O1 |
| Synonyms | (5-fluoro-1-benzofuran-2-yl)methanol,
276235-91-7,
(5-Fluorobenzofuran-2-yl)methanol,
2-hydroxymethyl-5-fluorobenzo[b]furan,
5-Fluoro-2-benzofuranmethanol,
SCHEMBL120404,
5-fluorobenzofuran-2-ylmethanol,
CTK8H9600,
VFXRFXAEZVQAHB-UHFFFAOYSA-N,
ZINC78675978,
AKOS006313038,
KS-0000245L,
AJ-122752,
CS-0021488,
CS-4099,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.151g/mol |
| Monoisotopic Mass | 166.043g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number