| CAS Number | 14604-44-5 |
| Catalog Number | AG01B7N5(AGN-PC-000R3C) |
| Chemical Name | 5-Methoxypent-1-yne |
| IUPAC Name | 5-methoxypent-1-yne |
| InChI | InChI=1S/C6H10O/c1-3-4-5-6-7-2/h1H,4-6H2,2H3 |
| InChI Key | CLISVFCXKLMNIJ-UHFFFAOYSA-N |
| MDL Number | MFCD20483379 |
| Molecular Formula | C6H10O |
| Molecular Weight | 98.143 |
| SMILES | COCCCC#C |
| Synonyms | 5-methoxypent-1-yne,
14604-44-5,
5-Methoxy-1-pentyne,
Methyl 4-pentynyl ether,
pent-4-yn-1-yl-methyl ether,
CLISVFCXKLMNIJ-UHFFFAOYSA-N,
ZINC34251241,
|
| Complexity | 67.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 98.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 98.145g/mol |
| Monoisotopic Mass | 98.073g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number