| CAS Number | 566189-47-7 |
| Catalog Number | AG019Y49(AGN-PC-05P3DE) |
| Chemical Name | 2-(But-3-en-1-yloxy)propanoic acid |
| IUPAC Name | 2-but-3-enoxypropanoic acid |
| InChI | InChI=1S/C7H12O3/c1-3-4-5-10-6(2)7(8)9/h3,6H,1,4-5H2,2H3,(H,8,9) |
| InChI Key | YZEUQGORHPHYHI-UHFFFAOYSA-N |
| MDL Number | MFCD10689873 |
| Molecular Formula | C7H12O3 |
| Molecular Weight | 144.1684 |
| SMILES | CC(C(O)=O)OCCC=C |
| Synonyms | 2-(but-3-en-1-yloxy)propanoic acid,
566189-47-7,
AC1Q2C3G,
SCHEMBL7242418,
CTK6A3473,
AKOS009262934,
MCULE-4921869592,
NE32857,
EN300-56964,
Z1259087020,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.17g/mol |
| Monoisotopic Mass | 144.079g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number