Barthrin
(6-chloro-1,3-benzodioxol-5-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
| Molecular Formula | C18H21ClO4 |
|---|---|
| Molecular Weight | 336.8 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 44.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.11282 |
| Heavy Atoms | 23 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 70-43-9 |
|---|---|
| SMILES | CC(=CC1C(C1(C)C)C(=O)OCC2=CC3=C(C=C2Cl)OCO3)C |
| InChIKey | KPMWGGRSOPMANK-UHFFFAOYSA-N |
📖 Product Overview
Barthrin (CAS: 70-43-9) is a chemical compound with molecular formula C18H21ClO4 and molecular weight 336.8 g/mol. Its IUPAC systematic name is (6-chloro-1,3-benzodioxol-5-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
KPMWGGRSOPMANK-UHFFFAOYSA-N.
SMILES: CC(=CC1C(C1(C)C)C(=O)OCC2=CC3=C(C=C2Cl)OCO3)C.
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