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1000 91 5 | Cheminformatics

Chemical : Dimethyl[(propan-2-yl)oxy]silane

Casrn : 1000-91-5

MolName : Dimethyl[(propan-2-yl)oxy]silane

MolecularFormula : C5H14OSi

Smiles : CC(C)O[SiH](C)C

InChI : InChI=1S/C5H14OSi/c1-5(2)6-7(3)4/h5,7H,1-4H3

InChIK : OARYFQYHTWCNQO-UHFFFAOYSA-N

CanonicalSyTyLFy : a0f5d142ea111358

TotalMolweight : 118.251

Molweight : 118.251

MonoisotopicMass : 118.081392

CLogP : 1.8781

CLogS : -0.901

H Acceptors : 1

TotalSurfaceArea : 91.79

Relative PSA : 0.10894

PolarSurfaceArea : 9.23

Druglikeness : -35.679

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : high

Nasty Functions :

Shape Index : 0.71429

Molecula Flexibility : 0.80857

Molecular Complexity : 0.4621

Fragments : 1

Non HAtoms : 7

NonCHAtoms : 2

Electronegative Atoms : 1

Rotatable Bond : 2

Sp3Atoms : 6

Symmetricatoms : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-58-3nonenonenoneBr.C6H5Mg101.411-2.3575
1000018-26-7nonenonenoneC16H23NO3277.363-15.052
100-70-9nonenonenoneC6H4N2104.112-6.0498
100-79-8nonelownoneC6H12O3132.158-9.8672
1000018-13-2nonenonenoneC11H14NO2Br272.141-5.4951
100-69-6nonenonenoneC7H7N105.14-4.4598
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
100-10-7nonehighhighC9H11NO149.192-1.8715
100-93-6highhighhighC19H18N2O2S338.43-12.848
100031-98-9nonenonehighC12H29O4F3Si4406.696-100.78
100010-99-9nonenonenoneC11H24O2188.31-23.185
100-68-5nonenonenoneC7H8S124.207-1.735
1000120-98-8highnonehighC230H305N67O122P19S197158.06-20.81
1000-86-8nonenonenoneC7H1296.1723-10.397
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
1000339-29-6nonenonenoneC14H15N2OBr307.19-5.8756
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
1000-77-7highhighnoneHCl.C6H15NO6S2261.3181.5333
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
1000018-22-3nonenonenoneC16H22N3O4Br400.272-33.051
100-52-7highhighhighC7H6O106.124-4.225
100-95-8nonenonenoneCl.C23H41N2O361.592-17.647
1000-58-4highhighhighC4H8Cl4Si226.006-54.611
1000018-59-6nonenonelowC10H15O2BrS279.197-14.078
100-17-4nonenonenoneC7H7NO3153.137-7.2945
100-86-7nonenonenoneC10H14O150.22-2.4187
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
100-97-0highhighhighC6H12N4140.1891.5849
100009-23-2nonenonehighC17H22226.362-9.7346
10-00-4nonenonenoneC28H34O8498.57-4.8409
100007-67-8highnonelowC5H7OClF2156.559-12.702
1000304-40-4nonenonenoneC11H17NO179.2622.2651
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
10-13-2009nonenonenoneC15H14O5274.271-1.4702
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
100-14-1highhighlowC7H6NO2Cl171.583-7.5061
100-46-9nonenonenoneC7H9N107.155-2.0712
1000339-34-3nonenonenoneC11H12N3OBr282.14-5.9074
100-56-1highlowlowC6H5ClHg313.149-2.3575
017257-81-7nonenonenoneC6H10O2114.1430.9106
100005-01-4nonenonehighC8H21BrSSi2285.397-52.815
1000-05-1nonenonehighC8H26O3Si4282.635-83.299
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988
10001-13-5nonenonehighC12H22N2O210.323.9217
100-26-5nonenonenoneC7H5NO4167.12-1.5746
100013-07-8nonenonenoneC18H32B.Li259.263-11.013
100031-88-7nonenonehighC10H30O3Si4310.689-53.619
100-04-9nonehighnoneCl.C8H10N3148.188-2.0275
1000-46-0nonenonenoneC7H18Ge174.83-4.6976
1000018-39-2highhighlowC13H20N2O2S268.381.9315
100-02-7nonenonenoneC6H5NO3139.11-7.5665
100-50-5nonenonehighC7H10O110.155-9.6048
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
1000068-23-4nonelownoneC14H18NO5B291.11-44.603
1000017-92-4nonenonenoneC6H4NBr2Cl285.366-3.6
10003-94-8nonenonenoneC9H16N2O18P4564.118-31.509
100033-12-3nonenonenoneC11H10N3O2Br296.123-13.354