| CAS Number | 135149-43-8 |
| Catalog Number | AG007LJ4(AGN-PC-03BE5T) |
| Chemical Name | Tert-butyl 5-formylthiophene-2-carboxylate |
| IUPAC Name | tert-butyl 5-formylthiophene-2-carboxylate |
| InChI | InChI=1S/C10H12O3S/c1-10(2,3)13-9(12)8-5-4-7(6-11)14-8/h4-6H,1-3H3 |
| InChI Key | AXGWEMGJOUIUMX-UHFFFAOYSA-N |
| MDL Number | MFCD25958248 |
| Molecular Formula | C10H12O3S |
| Molecular Weight | 212.2655 |
| SMILES | CC(OC(C1SC(C=O)=CC=1)=O)(C)C |
| Synonyms | 135149-43-8,
tert-butyl 5-formyl-2-thiophenecarboxylate,
tert-butyl 5-formylthiophene-2-carboxylate,
2-Thiophenecarboxylic acid, 5-formyl-, 1,1-dimethylethyl ester,
ACMC-20mvo5,
SCHEMBL1186228,
CTK0F4202,
DTXSID30614371,
AXGWEMGJOUIUMX-UHFFFAOYSA-N,
ZINC115438148,
t-butyl 5-formyl-2-thiophenecarboxylate,
5-formylthiophencarboxylic acid tert-butyl ester,
5-formyl-2-thiophencarboxylic acid tert-butyl ester,
5-formyl-thiophene-2-carboxylic acid tert-butyl ester,
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| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.263g/mol |
| Monoisotopic Mass | 212.051g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 71.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number