| CAS Number | 2809-75-8 |
| Catalog Number | AG01C0B8(AGN-PC-03DJX6) |
| Chemical Name | 1-Ethynyl-1-methylcyclopropane |
| IUPAC Name | 1-ethynyl-1-methylcyclopropane |
| InChI | InChI=1S/C6H8/c1-3-6(2)4-5-6/h1H,4-5H2,2H3 |
| InChI Key | DLXBUAFBLMXVMT-UHFFFAOYSA-N |
| MDL Number | MFCD27948672 |
| Molecular Formula | C6H8 |
| Molecular Weight | 80.1277 |
| SMILES | C#CC1(C)CC1 |
| Synonyms | 1-ethynyl-1-methylcyclopropane,
2809-75-8,
Cyclopropane, 1-ethynyl-1-methyl-,
1-ethynyl-1-methyl-cyclopropane,
DLXBUAFBLMXVMT-UHFFFAOYSA-N,
AKOS033999893,
ZINC113585783,
Z2731810727,
|
| Complexity | 98.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 80.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 80.13g/mol |
| Monoisotopic Mass | 80.063g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number