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656801 33 1 | Cheminformatics

Chemical : (1,2-Dichloroethene-1,2-diyl)bis[chloro(dimethyl)silane]

Casrn : 656801-33-1

MolName : (1,2-Dichloroethene-1,2-diyl)bis[chloro(dimethyl)silane]

MolecularFormula : C6H12Cl4Si2

Smiles : C[Si](C)(C(Cl)=C([Si](C)(C)Cl)Cl)Cl

InChI : InChI=1S/C6H12Cl4Si2/c1-11(2,9)5(7)6(8)12(3,4)10/h1-4H3

InChIK : ABBRNOZAGHGXSP-UHFFFAOYSA-N

CanonicalSyTyLFy : 4cdc403b23686592

TotalMolweight : 282.145

Molweight : 282.145

MonoisotopicMass : 279.923162

CLogP : 3.9268

CLogS : -3.074

TotalSurfaceArea : 174.14

Druglikeness : -56.43

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : high

Nasty Functions : 1,2-dihalo-alkene

Shape Index : 0.5

Molecula Flexibility : 0.69059

Molecular Complexity : 0.6868

Fragments : 1

Non HAtoms : 12

NonCHAtoms : 6

Electronegative Atoms : 4

Rotatable Bond : 2

Sp3Atoms : 4

Symmetricatoms : 7

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
1000010-11-6nonenonenoneC28H44N2O2440.669-21.689
100021-47-4nonenonenoneC13H17N5O6339.307-2.7249
100-62-9lownonenoneC7H7N105.14-1.1924
10-00-4nonenonenoneC28H34O8498.57-4.8409
100021-82-7nonenonenoneH3O4P.C18H38N2O298.513-22.282
1000018-58-5nonenonenoneC6H4NBr2Cl285.366-3.6
10000-42-7highhighlowC20H18N4O3362.388-5.7793
1000018-49-4nonenonenoneC14H19NO5S313.3732.5797
100-95-8nonenonenoneCl.C23H41N2O361.592-17.647
1000-00-6nonenonehighC10H26OSi2218.487-62.76
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
100-46-9nonenonenoneC7H9N107.155-2.0712
100-50-5nonenonehighC7H10O110.155-9.6048
100-47-0highnonehighC7H5N103.124-6.0498
100-45-8nonenonehighC7H9N107.155-10.018
100-68-5nonenonenoneC7H8S124.207-1.735
1000068-23-4nonelownoneC14H18NO5B291.11-44.603
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
10-13-2009nonenonenoneC15H14O5274.271-1.4702
100-12-9nonenonenoneC8H9NO2151.164-7.7443
100007-67-8highnonelowC5H7OClF2156.559-12.702
1000068-42-7nonenonenoneC10H11NO3BrFS324.169-2.2263
100020-94-8highnonelowC12H17OCl212.719-11.962
100-26-5nonenonenoneC7H5NO4167.12-1.5746
100033-28-1lownonehighC6H9N7179.186-2.3035
100004-79-3nonenonenoneC13H11NO2213.235-1.5864
100-44-7highhighnoneC7H7Cl126.586-2.365
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
100-04-9nonehighnoneCl.C8H10N3148.188-2.0275
10001-13-5nonenonehighC12H22N2O210.323.9217
100-70-9nonenonenoneC6H4N2104.112-6.0498
100-23-2nonehighnoneC8H10N2O2166.179-5.0759
1000-41-5nonenonelowC10H18O154.252-9.05
1000017-94-6nonenonenoneC8H5N2O2Cl196.5932.9136
1000-43-7highhighhighC8H18Cl2Si213.223-31.848
1000018-22-3nonenonenoneC16H22N3O4Br400.272-33.051
100008-36-4nonenonenoneC17H22O2258.36-5.6379
100-90-3nonenonenoneC14H16N4O3S320.3724.7301
1000-22-2lowhighlowC6H14O2FPS200.213-11.052
1000120-98-8highnonehighC230H305N67O122P19S197158.06-20.81
100-51-6highhighhighC7H8O108.14-2.2456
100019-40-7nonenonenoneC14H15NO3245.277-1.947
1000339-34-3nonenonenoneC11H12N3OBr282.14-5.9074
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
100020-34-6nonenonenoneC13H18S2238.418-0.23079
100010-21-7nonenonenoneC14H21NO219.327-4.2999
10002-97-8nonenonenoneC18H30O2278.4340.24997
1000-68-6nonenonenoneC3H9NO3S2171.24-3.0843
100-79-8nonelownoneC6H12O3132.158-9.8672
100005-12-7nonenonelowC11H10NCl191.662.2675
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
100-07-2highhighlowC8H7O2Cl170.595-10.49
100004-54-4nonehighnoneC4H8Te183.708-3.9699
100-48-1nonenonenoneC6H4N2104.112-6.0498
100-55-0nonenonenoneC6H7NO109.128-1.9045
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
1000-50-6nonenonehighC6H15ClSi150.724-84.768
100-33-4nonenonenoneC19H24N4O2340.426-7.2784
1000339-23-0nonenonenoneC6H5N2O2Br217.022-3.3311