| CAS Number | 94831-93-3 |
| Catalog Number | AG0067IW(AGN-PC-001KUR) |
| Chemical Name | 1-Fluoro-3-(prop-2-yn-1-yloxy)benzene |
| IUPAC Name | 1-fluoro-3-prop-2-ynoxybenzene |
| InChI | InChI=1S/C9H7FO/c1-2-6-11-9-5-3-4-8(10)7-9/h1,3-5,7H,6H2 |
| InChI Key | FXGXMJFFQWBIQY-UHFFFAOYSA-N |
| MDL Number | MFCD14631207 |
| Molecular Formula | C9H7FO |
| Molecular Weight | 150.1497 |
| SMILES | FC1=CC(OCC#C)=CC=C1 |
| Synonyms | 1-fluoro-3-(prop-2-yn-1-yloxy)benzene,
94831-93-3,
Benzene, 1-fluoro-3-(2-propynyloxy)-,
ACMC-20lz5k,
AC1Q4LTT,
SCHEMBL4808501,
CTK3F4470,
DTXSID20561163,
FXGXMJFFQWBIQY-UHFFFAOYSA-N,
ZINC34307653,
AKOS008950752,
NE53977,
1-Fluoro-3-[(prop-2-yn-1-yl)oxy]benzene,
EN300-71767,
Z54472195,
1-fluoro-3-prop-2-ynoxybenzene,
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| 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 | 2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number