1000 40 4 | Cheminformatics

Stannane, bis(butylthio)dimethyl-

Formula:C10H24S2Sn CAS:1000-40-4

PropertyValue
Casrn1000-40-4
MolNameStannane, bis(butylthio)dimethyl-
MolecularFormulaC10H24S2Sn
SmilesCCCCS[Sn](C)(C)SCCCC
InChIInChI=1S/2C4H10S.2CH3.Sn/c2*1-2-3-4-5;;;/h2*5H,2-4H2,1H3;2*1H3;/q;;;;+2/p-2
InChIKAZQSJLSJRUNLBI-UHFFFAOYSA-L
CanonicalSyTyLFy7398686ad1632e17
TotalMolweight327.143
Molweight327.143
MonoisotopicMass328.03414
CLogP5.1608
CLogS-3.318
TotalSurfaceArea193.58
Relative PSA0.1807
PolarSurfaceArea50.6
Druglikeness-7.0269
Mutagenichigh
Tumorigenicnone
Reproductive Effectivelow
Irritantlow
Nasty Functionsunwanted atom
Shape Index0.84615
Molecula Flexibility0.8162
Molecular Complexity0.39965
Fragments1
Non HAtoms13
NonCHAtoms3
Metal Atoms1
Electronegative Atoms2
Rotatable Bond8
Sp3Atoms12
Symmetricatoms6
StereoCon
CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-61-8highnonenoneC7H9N107.155-0.23765
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
1000018-39-2highhighlowC13H20N2O2S268.381.9315
100021-79-2nonehighhighC16H32O2.C2H8N2256.428-25.216
1000-41-5nonenonelowC10H18O154.252-9.05
100-97-0highhighhighC6H12N4140.1891.5849
100-67-4nonenonenoneK.C6H5O93.1047-2.2548
10003-42-6nonenonenoneC11H11NO4221.211-4.7046
100020-94-8highnonelowC12H17OCl212.719-11.962
100004-93-1nonehighnoneC16H11NO2249.268-1.5746
100-09-4nonenonenoneC8H8O3152.149-1.597
1000068-26-7nonenonenoneC13H15NO4BF279.074-46.077
1000-63-1nonenonehighC8H18O130.23-19.78
10001-52-2highhighnoneC11H10N6O3S306.3056.7202
1000-23-3highhighlowC4H6O4Cl2Sn307.704-8.6766
10001-51-1nonenonenoneC9H18N2O170.2555.9677
1000018-23-4nonenonenoneC12H17N3O3251.2852.8124
10001-46-4nonenonenoneC9H11N3O3209.2041.9565
100-77-6nonenonenoneC6H4N2Cl.Cl139.565-4.1248
1000339-13-8lownonelowC7H10NO4ClS239.678-21.883
1000017-94-6nonenonenoneC8H5N2O2Cl196.5932.9136
1000018-40-5lowhighnoneC11H16N2O2S240.3261.4856
10-13-2009nonenonenoneC15H14O5274.271-1.4702
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100-10-7nonehighhighC9H11NO149.192-1.8715
1000018-22-3nonenonenoneC16H22N3O4Br400.272-33.051
1000-28-8nonenonenoneC6H3OF11300.067-44.343
1000-69-7highnonelowC7H18SSn252.996-9.6969
100022-13-7nonenonenoneHCl.C20H21NO4339.392.3133
100002-29-7nonenonenoneC12H18N2O3238.2862.8956
1000000-13-4highhighhighC21H28O12472.441-0.17986
100009-92-5nonenonenoneC20H23NO4341.4064.6216
10001-30-6nonenonenoneC17H14O4282.294-0.8408
1000-70-0nonelowhighC7H18N2Si2186.406-43.673
100-68-5nonenonenoneC7H8S124.207-1.735
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
1000339-31-0nonenonehighC12H16NCl209.7190.65299
100007-67-8highnonelowC5H7OClF2156.559-12.702
1000339-54-7nonenonenoneC9H7O2F3204.147-11.176
100-50-5nonenonehighC7H10O110.155-9.6048
1000303-67-2nonenonenoneC6H8N2O124.1432.717
100010-02-4nonenonenoneC14H23NO221.343-6.1109
1000025-92-2nonenonenoneC20H16N2O2316.359-6.3825
1000-78-8highlownoneC11H24N2184.326-10.254
1000-58-4highhighhighC4H8Cl4Si226.006-54.611
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
10-18-2004nonenonenoneC6H8OS2160.261-3.1913
10001-13-5nonenonehighC12H22N2O210.323.9217
100-38-9nonenonehighC6H15NS133.2580.17671
100031-98-9nonenonehighC12H29O4F3Si4406.696-100.78
1000017-98-0nonenonenoneC8H4N2O2BrCl275.489-2.5326
100004-78-2nonenonenoneC16H11NO2249.268-1.5746
100-81-2nonenonenoneC8H11N121.182-2.1005
1000296-70-7nonenonenoneC19H27NO7S3477.6213.1322
017257-81-7nonenonenoneC6H10O2114.1430.9106
100-75-4highhighhighC5H10N2O114.147-0.86877
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
100-73-2highnonenoneC6H8O2112.128-6.3422
100-94-7nonenonenoneCl.C16H20N226.342-1.9788