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656801 32 0 | Cheminformatics

Chemical : (1,1,2,2-Tetrachloroethane-1,2-diyl)bis[(dichloromethyl)silane]

Casrn : 656801-32-0

MolName : (1,1,2,2-Tetrachloroethane-1,2-diyl)bis[(dichloromethyl)silane]

MolecularFormula : C4H6Cl8Si2

Smiles : ClC([SiH2]C(C([SiH2]C(Cl)Cl)(Cl)Cl)(Cl)Cl)Cl

InChI : InChI=1S/C4H6Cl8Si2/c5-1(6)13-3(9,10)4(11,12)14-2(7)8/h1-2H,13-14H2

InChIK : CDUDGOFEMBUHKJ-UHFFFAOYSA-N

CanonicalSyTyLFy : 7411307367d631db

TotalMolweight : 393.888

Molweight : 393.888

MonoisotopicMass : 389.75162

CLogP : 4.56

CLogS : -2.058

TotalSurfaceArea : 182.68

Druglikeness : -13.499

Mutagenic : high

Tumorigenic : low

Reproductive Effective : high

Irritant : high

Nasty Functions :

Shape Index : 0.57143

Molecula Flexibility : 0.8836

Molecular Complexity : 0.61481

Fragments : 1

Non HAtoms : 14

NonCHAtoms : 10

Electronegative Atoms : 8

Rotatable Bond : 5

Sp3Atoms : 4

Symmetricatoms : 9

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100016-58-8nonehighnoneC19H19NO5341.3621.8385
100009-92-5nonenonenoneC20H23NO4341.4064.6216
1000-57-3highnonelowC6H16SSn238.969-7.4261
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
100004-54-4nonehighnoneC4H8Te183.708-3.9699
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
10000-51-8nonenonenoneC14H15NO3245.2770.10503
1000-77-7highhighnoneHCl.C6H15NO6S2261.3181.5333
100-85-6nonenonenoneHO.C10H16N150.244-2.6575
100-94-7nonenonenoneCl.C16H20N226.342-1.9788
100008-89-7nonenonenoneC11H10N4O3246.225-1.8465
1000160-75-7nonenonelowC14H17O2BS260.164-20.35
100020-34-6nonenonenoneC13H18S2238.418-0.23079
100011-00-5nonenonenoneC15H24O2236.354-18.044
100001-06-7nonenonenoneI.C20H28NO298.448-2.3411
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
1000284-35-4nonenonehighC16H24O4280.363-11.936
100004-93-1nonehighnoneC16H11NO2249.268-1.5746
1000339-34-3nonenonenoneC11H12N3OBr282.14-5.9074
1000339-54-7nonenonenoneC9H7O2F3204.147-11.176
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
100008-36-4nonenonenoneC17H22O2258.36-5.6379
1000018-50-7nonenonenoneC13H16N2O4264.28-7.3568
1000339-52-5nonenonenoneC7H3N2O2F166.111-12.761
1000339-55-8nonenonenoneC9H7O2F3204.147-12.197
100-79-8nonelownoneC6H12O3132.158-9.8672
1000058-38-7nonenonenoneC11H12N2O2204.228-4.6529
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
100004-78-2nonenonenoneC16H11NO2249.268-1.5746
100033-28-1lownonehighC6H9N7179.186-2.3035
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
1000-63-1nonenonehighC8H18O130.23-19.78
100010-00-2nonenonenoneC20H23NO5357.405-3.7157
100021-82-7nonenonenoneH3O4P.C18H38N2O298.513-22.282
100033-12-3nonenonenoneC11H10N3O2Br296.123-13.354
1000017-98-0nonenonenoneC8H4N2O2BrCl275.489-2.5326
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
100-74-3highnonehighC6H13NO115.1753.7593
100-49-2nonenonenoneC7H14O114.187-9.3679
100019-40-7nonenonenoneC14H15NO3245.277-1.947
100033-59-8nonenonenoneC8H16N2140.2290.9406
1000068-25-6nonenonenoneC13H15NO4BF279.074-46.077
10003-69-7nonenonenoneC10H14O8S4390.4770.2775
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
100-11-8lowhighnoneC7H6NO2Br216.034-13.162
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
1000018-59-6nonenonelowC10H15O2BrS279.197-14.078
100-40-3nonenonehighC8H12108.183-9.1684
1000-68-6nonenonenoneC3H9NO3S2171.24-3.0843
100-91-4nonenonehighC17H25NO3291.393.3475
100-47-0highnonehighC7H5N103.124-6.0498
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
100-64-1highhighnoneC6H11NO113.159-6.4182
1000269-65-7nonenonenoneC12H19N3205.3040.25629
1000171-05-0nonenonenoneC27H37O3P440.562-24.592
100005-79-6nonenonenoneC12H9NS199.276-2.6106
1000000-13-4highhighhighC21H28O12472.441-0.17986
100-92-5nonenonenoneC11H17N163.2631.1672
100-66-3highnonehighC7H8O108.14-2.0846