| CAS Number | 922735-06-6 |
| Catalog Number | AG01B5JL |
| Chemical Name | 1-Ethoxy-3-ethynylbenzene |
| IUPAC Name | 1-ethoxy-3-ethynylbenzene |
| InChI | InChI=1S/C10H10O/c1-3-9-6-5-7-10(8-9)11-4-2/h1,5-8H,4H2,2H3 |
| InChI Key | GXHPKYAAABZZRJ-UHFFFAOYSA-N |
| MDL Number | MFCD08703564 |
| Molecular Formula | C10H10O |
| Molecular Weight | 146.1858 |
| SMILES | CCOC1=CC(C#C)=CC=C1 |
| Synonyms | 1-ETHOXY-3-ETHYNYLBENZENE,
922735-06-6,
SCHEMBL12251491,
ZINC58626264,
AKOS010651518,
Benzene, 1-ethoxy-3-ethynyl,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.189g/mol |
| Monoisotopic Mass | 146.073g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number