TL;DR: Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester (CAS 97383-42-1) is a chemical compound with molecular formula C11H12O4S and molecular weight 240.04562 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 1-(benzenesulfonyl)cyclopropane-1-carboxylate
Also Known As: methyl 1-(benzenesulfonyl)cyclopropane-1-carboxylate, Benzo(a)pyrene-3,6-quinol monoglucuronide, methyl 1-(phenylsulfonyl)cyclopropanecarboxylate, Methyl 1-phenylsulfonylcyclopropanecarboxylate, Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester
| Molecular Formula | C11H12O4S |
| Molecular Weight | 240.04562 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 68.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.04562 Da |
| Heavy Atoms | 16 |
| Complexity | 369.0 |
| SMILES | COC(=O)C1(CC1)S(=O)(=O)C2=CC=CC=C2 |
| InChIKey | OACLWBSJZSLACO-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester. Following Lipinski's Rule of Five, Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester is 97383-42-1.
The molecular formula of Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester is C11H12O4S.
The molecular weight of Cyclopropanecarboxylic acid, 1-(phenylsulfonyl)-, methyl ester is 240.04562 g/mol.
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