TL;DR: 7-Pentadecyne, 1-chloro-13-methyl- (CAS 71317-61-8) is a chemical compound with molecular formula C16H29Cl and molecular weight 256.19577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-13-methylpentadec-7-yne
Also Known As: 1-chloro-13-methylpentadec-7-yne, 7-Pentadecyne, 1-chloro-13-methyl-, 1-Chloro-13-methyl-7-pentadecyne
| Molecular Formula | C16H29Cl |
| Molecular Weight | 256.19577 g/mol |
| XLogP | 7.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 10 |
| Exact Mass | 256.19577 Da |
| Heavy Atoms | 17 |
| Complexity | 208.0 |
| SMILES | CCC(C)CCCCC#CCCCCCCCl |
| InChIKey | HTWKNNJMZHCKAI-UHFFFAOYSA-N |
The XLogP value of 7.1 indicates that 7-Pentadecyne, 1-chloro-13-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 7-Pentadecyne, 1-chloro-13-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Pentadecyne, 1-chloro-13-methyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 7-Pentadecyne, 1-chloro-13-methyl- is 71317-61-8.
The molecular formula of 7-Pentadecyne, 1-chloro-13-methyl- is C16H29Cl.
The molecular weight of 7-Pentadecyne, 1-chloro-13-methyl- is 256.19577 g/mol.
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