| CAS Number | 156146-14-4 |
| Catalog Number | AG001OJR(AGN-PC-0MWUR3) |
| Chemical Name | (but-3-yn-1-yloxy)benzene |
| IUPAC Name | but-3-ynoxybenzene |
| InChI | InChI=1S/C10H10O/c1-2-3-9-11-10-7-5-4-6-8-10/h1,4-8H,3,9H2 |
| InChI Key | LMJIECGJNREYCB-UHFFFAOYSA-N |
| MDL Number | MFCD18851453 |
| Molecular Formula | C10H10O |
| Molecular Weight | 146.1858 |
| SMILES | C#CCCOC1=CC=CC=C1 |
| Synonyms | (but-3-yn-1-yloxy)benzene,
156146-14-4,
Benzene, (3-butyn-1-yloxy)-,
4-Phenyloxybut-1-yne,
(3-Butynyloxy)benzene,
(but-3-ynyloxy)benzene,
Benzene, (3-butynyloxy)-,
SCHEMBL386609,
CTK0B0688,
DTXSID30433680,
LMJIECGJNREYCB-UHFFFAOYSA-N,
ZINC34060439,
AKOS012965693,
MCULE-2476958652,
NE41135,
Z1533238363,
But-3-ynoxybenzene,
CID9989389,
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| Complexity | 136 |
| 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 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number