| CAS Number | 90124-74-6 |
| Catalog Number | AG00GWUX(AGN-PC-00108Q) |
| Chemical Name | (E/Z)-2-Propyl-2-pentenoic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-propylpent-2-enoate |
| InChI | InChI=1S/C10H18O2/c1-4-7-9(8-5-2)10(11)12-6-3/h7H,4-6,8H2,1-3H3 |
| InChI Key | VGICYSRIICMHCP-UHFFFAOYSA-N |
| Molecular Formula | C10H18O2 |
| Molecular Weight | 170.2487 |
| SMILES | CCCC(=C/CC)C(=O)OCC |
| Synonyms | (E,Z) 2-Propyl-2-pentenoic Acid Ethyl Ester,
90124-74-6,
CTK1I6040,
CTK8F1979,
VGICYSRIICMHCP-UHFFFAOYSA-N,
2-propyl-2-pentenoic acid ethyl ester,
AKOS030255442,
FT-0674113,
2-Pentenoic acid, 2-propyl-, ethyl ester, (E)-,
63718-45-6,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.252g/mol |
| Monoisotopic Mass | 170.131g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number