| CAS Number | 134126-59-3 |
| Catalog Number | AG01AP0J |
| Chemical Name | 2-(Prop-2-yn-1-yloxy)propanoic acid |
| IUPAC Name | 2-prop-2-ynoxypropanoic acid |
| InChI | InChI=1S/C6H8O3/c1-3-4-9-5(2)6(7)8/h1,5H,4H2,2H3,(H,7,8) |
| InChI Key | ASOPQMMSXAFJQU-UHFFFAOYSA-N |
| MDL Number | MFCD10694625 |
| Molecular Formula | C6H8O3 |
| Molecular Weight | 128.1259 |
| SMILES | CC(C(O)=O)OCC#C |
| Synonyms | 2-(Prop-2-yn-1-yloxy)propanoic acid,
134126-59-3,
2-(Prop-2-ynyloxy)propanoic acid,
SCHEMBL3528461,
1-(1-Carboxyethoxy)prop-2-yne,
2-(2-propynyloxy)propanoic acid,
ASOPQMMSXAFJQU-UHFFFAOYSA-N,
MFCD10694625,
AKOS005199865,
Z2234631190,
|
| Complexity | 142 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.127g/mol |
| Monoisotopic Mass | 128.047g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number