AC1M1S87
4-(3-chloro-1-benzothiophene-2-carbonyl)oxybut-2-ynyl 3-chloro-1-benzothiophene-2-carboxylate
Also Known As: UPCMLD0ENAT0502-0358:001|AF-399/37271022|but-2-yne-1,4-diyl bis(3-chlorobenzo[b]thiophene-2-carboxylate)|4-(3-chloro-1-benzothiophene-2-carbonyl)oxybut-2-ynyl 3-chloro-1-benzothiophene-2-carboxylate|4-{[(3-chloro-1-benzothien-2-yl)carbonyl]oxy}-2-butynyl 3-chloro-1-benzothiophene-2-carboxylate
CAS: 302575-89-9
| Molecular Formula | C22H12Cl2O4S2 |
|---|---|
| Molecular Weight | 473.9554 g/mol |
| LogP | 6.44 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 473.9554 |
| Monoisotopic Mass | 473.9554 |
| Heavy Atoms | 30 |
| Complexity | 1227.4062 |
Chemical Identifiers
| CAS Number | 302575-89-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C(=O)OCC#CCOC(=O)C3=C(C4=CC=CC=C4S3)Cl)Cl |
Product Overview
AC1M1S87 (CAS 302575-89-9), with molecular formula C22H12Cl2O4S2 and molecular weight 473.9554 g/mol. IUPAC: 4-(3-chloro-1-benzothiophene-2-carbonyl)oxybut-2-ynyl 3-chloro-1-benzothiophene-2-carboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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