TL;DR: Silane, diisothiocyanatodimethyl- (CAS 13125-51-4) is a chemical compound with molecular formula C4H6N2S2Si and molecular weight 173.97417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diisothiocyanato(dimethyl)silane
Also Known As: Dimethyldiisothiocyanatosilane, Silane, diisothiocyanatodimethyl-, Diisothiocyanatodimethylsilane, Diisothiocyanato(dimethyl)silane, Diisothiocyanatodi(methyl)silane
| Molecular Formula | C4H6N2S2Si |
| Molecular Weight | 173.97417 g/mol |
| XLogP | 1.89 |
| Topological Polar Surface Area (TPSA) | 88.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.97417 Da |
| Heavy Atoms | 9 |
| Complexity | 169.0 |
| SMILES | C[Si](C)(N=C=S)N=C=S |
| InChIKey | WCCKEPKWCKHBLU-UHFFFAOYSA-N |
The XLogP value of 1.89 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Silane, diisothiocyanatodimethyl-. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Silane, diisothiocyanatodimethyl-. Following Lipinski's Rule of Five, Silane, diisothiocyanatodimethyl- 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 Silane, diisothiocyanatodimethyl- is 13125-51-4.
The molecular formula of Silane, diisothiocyanatodimethyl- is C4H6N2S2Si.
The molecular weight of Silane, diisothiocyanatodimethyl- is 173.97417 g/mol.
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