Chemical : Trimethyl(propylsulfanyl)stannane
Casrn : 1000-57-3 |
MolName : Trimethyl(propylsulfanyl)stannane |
MolecularFormula : C6H16SSn |
Smiles : CCCS[Sn](C)(C)C |
InChI : InChI=1S/C3H8S.3CH3.Sn/c1-2-3-4;;;;/h4H,2-3H2,1H3;3*1H3;/q;;;;+1/p-1 |
InChIK : XSHHHXXCASXJAZ-UHFFFAOYSA-M |
CanonicalSyTyLFy : db5bccfaf746b45a |
TotalMolweight : 238.969 |
Molweight : 238.969 |
MonoisotopicMass : 239.99947 |
CLogP : 3.5194 |
CLogS : -2.034 |
TotalSurfaceArea : 121.05 |
Relative PSA : 0.14449 |
PolarSurfaceArea : 25.3 |
Druglikeness : -7.4261 |
Mutagenic : high |
Tumorigenic : none |
Reproductive Effective : low |
Irritant : low |
Nasty Functions : unwanted atom |
Shape Index : 0.75 |
Molecula Flexibility : 0.80735 |
Molecular Complexity : 0.53648 |
Fragments : 1 |
Non HAtoms : 8 |
NonCHAtoms : 2 |
Metal Atoms : 1 |
Electronegative Atoms : 1 |
Rotatable Bond : 3 |
Sp3Atoms : 7 |
Symmetricatoms : 2 |
StereoCon : |
CAS Number | Mutagenic | Tumorigenic | Irritant | Molecule Formula | Mol Weight | Druglikeness |
---|---|---|---|---|---|---|
1000339-33-2 | none | none | none | C10H11NClF | 199.655 | 0.76 |
1000339-52-5 | none | none | none | C7H3N2O2F | 166.111 | -12.761 |
100033-28-1 | low | none | high | C6H9N7 | 179.186 | -2.3035 |
1000-82-4 | low | high | high | C2H6N2O2 | 90.0816 | 0.41759 |
1000018-06-3 | none | none | none | C8H8N3Br | 226.077 | 0.34749 |
100-48-1 | none | none | none | C6H4N2 | 104.112 | -6.0498 |
100021-81-6 | none | none | none | H3O4P.C20H42N2O | 326.566 | -22.282 |
100011-01-6 | none | none | none | C9H18O2 | 158.24 | -2.3462 |
1000-90-4 | none | none | none | Zn.C4H7OS2.C4H7OS2 | 135.231 | -2.7683 |
100-23-2 | none | high | none | C8H10N2O2 | 166.179 | -5.0759 |
1000-05-1 | none | none | high | C8H26O3Si4 | 282.635 | -83.299 |
100-56-1 | high | low | low | C6H5ClHg | 313.149 | -2.3575 |
1000-22-2 | low | high | low | C6H14O2FPS | 200.213 | -11.052 |
1000018-59-6 | none | none | low | C10H15O2BrS | 279.197 | -14.078 |
1000289-40-6 | none | none | none | C7H4N2Br2S | 307.997 | -2.2608 |
100-29-8 | none | none | none | C8H9NO3 | 167.163 | -8.928 |
100-58-3 | none | none | none | Br.C6H5Mg | 101.411 | -2.3575 |
100-44-7 | high | high | none | C7H7Cl | 126.586 | -2.365 |
1000269-51-1 | none | none | none | C13H12NO4B | 257.052 | -12.285 |
10-35-5 | none | none | none | C4H6O2BrF | 184.992 | -23.473 |
100020-83-5 | none | none | low | C7H11O3B | 153.972 | -20.814 |
100-89-0 | none | none | low | C18H36O6B2 | 370.1 | -16.157 |
100-99-2 | none | none | low | C12H27Al | 198.328 | -22.009 |
100004-94-2 | none | none | none | C13H11NO2 | 213.235 | -1.5864 |
1000068-24-5 | none | none | low | C13H15NO4BCl | 295.529 | -44.638 |
1000-58-4 | high | high | high | C4H8Cl4Si | 226.006 | -54.611 |
1000018-52-9 | none | none | none | C11H12N2O2S2 | 268.36 | 1.3179 |
1000-41-5 | none | none | low | C10H18O | 154.252 | -9.05 |
1000018-58-5 | none | none | none | C6H4NBr2Cl | 285.366 | -3.6 |
1000335-27-2 | none | none | none | C10H15N4OCl | 242.709 | 0.81574 |
10000-42-7 | high | high | low | C20H18N4O3 | 362.388 | -5.7793 |
1000339-28-5 | none | none | none | C14H8N2OBrCl | 335.588 | -0.59356 |
100008-36-4 | none | none | none | C17H22O2 | 258.36 | -5.6379 |
100-73-2 | high | none | none | C6H8O2 | 112.128 | -6.3422 |
1000018-23-4 | none | none | none | C12H17N3O3 | 251.285 | 2.8124 |
100-05-0 | none | none | none | Cl.C6H4N3O2 | 150.117 | -9.1371 |
100-45-8 | none | none | high | C7H9N | 107.155 | -10.018 |
1000339-45-6 | none | none | high | C8H14O2F2 | 180.193 | -28.199 |
1000339-32-1 | none | none | none | C11H14NF | 179.237 | 0.6275 |
1000018-48-3 | none | none | none | C12H15NO4S | 269.32 | 1.5148 |
100009-23-2 | none | none | high | C17H22 | 226.362 | -9.7346 |
1000018-49-4 | none | none | none | C14H19NO5S | 313.373 | 2.5797 |
100031-76-3 | none | none | none | C30H44NO8P | 577.652 | -46.719 |
100-02-7 | none | none | none | C6H5NO3 | 139.11 | -7.5665 |
100-96-9 | high | none | none | C7H10N2O | 138.169 | -1.7412 |
10001-30-6 | none | none | none | C17H14O4 | 282.294 | -0.8408 |
1000339-55-8 | none | none | none | C9H7O2F3 | 204.147 | -12.197 |
100-82-3 | none | none | none | C7H8NF | 125.146 | -3.4112 |
100-10-7 | none | high | high | C9H11NO | 149.192 | -1.8715 |
100020-95-9 | high | none | low | C12H17OCl | 212.719 | -11.962 |
100-25-4 | none | none | none | C6H4N2O4 | 168.108 | -7.74 |
100007-57-6 | none | none | none | C72H113N19O24S6 | 1821.19 | -13.821 |
100-53-8 | none | high | high | C7H8S | 124.207 | -6.3177 |
1000018-44-9 | none | none | none | C13H16N2O5 | 280.279 | -2.3885 |
1000017-93-5 | none | none | none | C8H5N2O2Cl | 196.593 | 2.9136 |
100-70-9 | none | none | none | C6H4N2 | 104.112 | -6.0498 |
100010-02-4 | none | none | none | C14H23NO | 221.343 | -6.1109 |
100-76-5 | none | none | high | C7H13N | 111.187 | 3.5517 |
100-09-4 | none | none | none | C8H8O3 | 152.149 | -1.597 |
100-17-4 | none | none | none | C7H7NO3 | 153.137 | -7.2945 |