TL;DR: 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl- (CAS 100971-92-4) is a chemical compound with molecular formula C14H18O2 and molecular weight 218.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,3,3-tetramethyl-2H-indene-5-carboxylic acid
Also Known As: 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl-, 1,1,3,3-tetramethyl-2H-indene-5-carboxylic Acid, 1,1,3,3-tetramethyl-2,3-dihydro-1H-indene-5-carboxylic acid, 1,1,3,3-Tetramethylindan-5-carboxylic acid, 1,1,3,3-tetramethyl-indan-5-carboxylic acid
| Molecular Formula | C14H18O2 |
| Molecular Weight | 218.13068 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.13068 Da |
| Heavy Atoms | 16 |
| Complexity | 304.0 |
| SMILES | CC1(CC(C2=C1C=CC(=C2)C(=O)O)(C)C)C |
| InChIKey | LOGJNALLOWJWGG-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl- is 100971-92-4.
The molecular formula of 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl- is C14H18O2.
The molecular weight of 1H-Indene-5-carboxylic acid, 2,3-dihydro-1,1,3,3-tetramethyl- is 218.13068 g/mol.
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