| CAS Number | 113714-11-7 |
| Catalog Number | AG01AB7O(AGN-PC-00O6YU) |
| Chemical Name | 1-Fluoro-2-(prop-2-yn-1-yloxy)benzene |
| IUPAC Name | 1-fluoro-2-prop-2-ynoxybenzene |
| InChI | InChI=1S/C9H7FO/c1-2-7-11-9-6-4-3-5-8(9)10/h1,3-6H,7H2 |
| InChI Key | NYPHWSBGBCOPCM-UHFFFAOYSA-N |
| MDL Number | MFCD14631272 |
| Molecular Formula | C9H7FO |
| Molecular Weight | 150.1497 |
| SMILES | FC1=C(OCC#C)C=CC=C1 |
| Synonyms | 1-fluoro-2-(prop-2-yn-1-yloxy)benzene,
113714-11-7,
Benzene, 1-fluoro-2-(2-propyn-1-yloxy)-,
AC1Q4LHC,
2-Fluorophenylpropargyl ether,
SCHEMBL4817251,
1-Fluoro-2-prop-2-ynoxybenzene,
ZINC34165450,
AKOS008951031,
MCULE-5508845302,
NE37165,
EN300-70707,
A1-05200,
Z54554294,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 150.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 150.152g/mol |
| Monoisotopic Mass | 150.048g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number