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96694 11 0 | Cheminformatics

Chemical : (2,2-Dimethoxyethenyl)(trimethyl)silane

Casrn : 96694-11-0

MolName : (2,2-Dimethoxyethenyl)(trimethyl)silane

MolecularFormula : C7H16O2Si

Smiles : COC(OC)=C[Si](C)(C)C

InChI : InChI=1S/C7H16O2Si/c1-8-7(9-2)6-10(3,4)5/h6H,1-5H3

InChIK : BVRBRYPTWDHQOW-UHFFFAOYSA-N

CanonicalSyTyLFy : dbb108e71fd6b450

TotalMolweight : 160.288

Molweight : 160.288

MonoisotopicMass : 160.091957

CLogP : 2.3908

CLogS : -2.405

H Acceptors : 2

TotalSurfaceArea : 133.01

Relative PSA : 0.15036

PolarSurfaceArea : 18.46

Druglikeness : -55.256

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : high

Nasty Functions :

Shape Index : 0.6

Molecula Flexibility : 0.66857

Molecular Complexity : 0.57565

Fragments : 1

Non HAtoms : 10

NonCHAtoms : 3

Electronegative Atoms : 2

Rotatable Bond : 3

Sp3Atoms : 7

Symmetricatoms : 4

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
1000018-26-7nonenonenoneC16H23NO3277.363-15.052
100-67-4nonenonenoneK.C6H5O93.1047-2.2548
100005-68-3nonenonenoneC13H12O4232.234-4.9451
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
1000339-55-8nonenonenoneC9H7O2F3204.147-12.197
1000-28-8nonenonenoneC6H3OF11300.067-44.343
100009-99-2lowhighnoneC21H25NO4355.4332.9337
100-13-0nonenonelowC8H7NO2149.149-10.212
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
100007-67-8highnonelowC5H7OClF2156.559-12.702
1000269-51-1nonenonenoneC13H12NO4B257.052-12.285
100-19-6nonenonenoneC8H7NO3165.148-7.0365
10-18-2004nonenonenoneC6H8OS2160.261-3.1913
100-85-6nonenonenoneHO.C10H16N150.244-2.6575
1000010-11-6nonenonenoneC28H44N2O2440.669-21.689
100-49-2nonenonenoneC7H14O114.187-9.3679
1000025-93-3nonenonenoneC20H17NO4335.358-1.6731
1000339-30-9nonenonenoneC8H10N3Cl183.6412.1
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
1000-22-2lowhighlowC6H14O2FPS200.213-11.052
100009-88-9nonenonenoneC18H45N7359.604-4.1108
1000339-22-9nonenonenoneC8H5NO4F2217.127-8.0943
100013-07-8nonenonenoneC18H32B.Li259.263-11.013
100-74-3highnonehighC6H13NO115.1753.7593
1000-40-4highnonelowC10H24S2Sn327.143-7.0269
1000339-31-0nonenonehighC12H16NCl209.7190.65299
1000339-29-6nonenonenoneC14H15N2OBr307.19-5.8756
100016-73-7highhighhighC6H5OCl.C10H16O.CH2O152.236-3.7075
100005-79-6nonenonenoneC12H9NS199.276-2.6106
100008-89-7nonenonenoneC11H10N4O3246.225-1.8465
100-71-0nonenonenoneC7H9N107.155-2.2725
100008-90-0nonenonenoneC12H11N3O3245.237-1.9187
100027-27-8nonenonenoneCH3I.C20H24N2292.4253.4994
1000-87-9nonenonenoneC7H1296.1723-2.6557
1000-46-0nonenonenoneC7H18Ge174.83-4.6976
100021-84-9highhighhighH3O4P.C18H36O2.C2H8N2284.482-25.216
1000018-10-9nonenonenoneC7H8N2OBr2295.962-5.2121
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
100-64-1highhighnoneC6H11NO113.159-6.4182
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
100-61-8highnonenoneC7H9N107.155-0.23765
1000-83-5lowhighhighC2H6N2OS106.149-2.264
100-07-2highhighlowC8H7O2Cl170.595-10.49
100-10-7nonehighhighC9H11NO149.192-1.8715
1000-67-5nonenonehighC4H9O4S.Na153.177-10.412
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
100-32-3nonenonenoneC12H8N2O4S2308.338-7.3436
100020-34-6nonenonenoneC13H18S2238.418-0.23079
1000171-05-0nonenonenoneC27H37O3P440.562-24.592
100021-81-6nonenonenoneH3O4P.C20H42N2O326.566-22.282
1000018-51-8nonenonenoneC10H10N2O2S2254.3331.3137
100-46-9nonenonenoneC7H9N107.155-2.0712
1000339-51-4nonenonenoneC7H4NO4F185.11-8.2861
1000296-71-8nonenonehighC19H27NO8S3493.62-2.9952
10002-37-6nonenonenoneC9H16N2O168.239-3.8085
1000018-52-9nonenonenoneC11H12N2O2S2268.361.3179
100-14-1highhighlowC7H6NO2Cl171.583-7.5061