Methyl propyl tetrasulphide
PubChem CID: 528709
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| Compound Synonyms | Methyl propyl tetrasulfide, Methyl propyl tetrasulphide, 87148-08-1, EINECS 289-302-3, DTXSID10236151, 1-(methyltetrasulfanyl)propane, DTXCID10158642, NS00124749, 289-302-3 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 101.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Deep Smiles | CCCSSSSC |
| Heavy Atom Count | 8.0 |
| Classyfire Class | Sulfenyl compounds |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 39.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-(methyltetrasulfanyl)propane |
| Veber Rule | True |
| Classyfire Superclass | Organosulfur compounds |
| Xlogp | 2.7 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C4H10S4 |
| Inchi Key | QQHQQGRHGUQYLO-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 5.0 |
| Synonyms | methyl-propyl-tetrasulfide, propyl tetrasulfide, methyl |
| Esol Class | Soluble |
| Functional Groups | CSSSSC |
| Compound Name | Methyl propyl tetrasulphide |
| Exact Mass | 185.967 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 185.967 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 186.4 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C4H10S4/c1-3-4-6-8-7-5-2/h3-4H2,1-2H3 |
| Smiles | CCCSSSSC |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
- 1. Outgoing r'ship
FOUND_INto/from Allium Cepa (Plant) Rel Props:Reference:ISBN:9780896038776 - 2. Outgoing r'ship
FOUND_INto/from Azadirachta Indica (Plant) Rel Props:Reference:ISBN:9780896038776