111291-97-5
Product Name:
TERT-BUTYL 4-ETHYNYLBENZOATE
Formula:
C13H14O2
Synonyms:
4-Ethynylbenzoic acid methyl ester
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 202.25 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 202.099379685 g/mol |
| Monoisotopic Mass | 202.099379685 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 269 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |