| CAS Number | 123844-20-2 |
| Catalog Number | AG00AFYR(AGN-PC-0JU71A) |
| Chemical Name | ethyl 3-cyclopropylprop-2-ynoate |
| IUPAC Name | ethyl 3-cyclopropylprop-2-ynoate |
| InChI | InChI=1S/C8H10O2/c1-2-10-8(9)6-5-7-3-4-7/h7H,2-4H2,1H3 |
| InChI Key | YQKWSKCBPAMHEJ-UHFFFAOYSA-N |
| MDL Number | MFCD28127816 |
| Molecular Formula | C8H10O2 |
| Molecular Weight | 138.1638 |
| SMILES | CCOC(C#CC1CC1)=O |
| Synonyms | ethyl 3-cyclopropylprop-2-ynoate,
123844-20-2,
Ethyl 3-cyclopropylpropiolate,
AC1LCZNT,
Ethylcyclopropylpropiolate,
SCHEMBL1513587,
YQKWSKCBPAMHEJ-UHFFFAOYSA-N,
ZINC32299042,
cyclopropyl-propynoic acid ethyl ester,
CS-0055985,
FT-0726426,
2-propynoic acid, 3-cyclopropyl-, ethyl ester,
InChI=1/C8H10O2/c1-2-10-8(9)6-5-7-3-4-7/h7H,2-4H2,1H,
CID639964,
2-Propynoic acid, 3-cyclopropyl-, ethyl ester (9CI),
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.166g/mol |
| Monoisotopic Mass | 138.068g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number