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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
1000120-98-8highnonehighC230H305N67O122P19S197158.06-20.81
100007-55-4nonenonenoneC35H39O19763.676-1.2907
100-29-8nonenonenoneC8H9NO3167.163-8.928
100005-12-7nonenonelowC11H10NCl191.662.2675
1000025-59-1nonenonenoneC14H11O3Cl262.691-1.449
1000-44-8highhighlowC7H7Cl126.586-8.5908
100-09-4nonenonenoneC8H8O3152.149-1.597
100-67-4nonenonenoneK.C6H5O93.1047-2.2548
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
1000339-29-6nonenonenoneC14H15N2OBr307.19-5.8756
100004-80-6nonenonenoneC13H11NO3229.234-1.3547
1000339-27-4nonenonenoneC14H8N3O3Br346.14-5.8142
100-26-5nonenonenoneC7H5NO4167.12-1.5746
1000025-92-2nonenonenoneC20H16N2O2316.359-6.3825
100-96-9highnonenoneC7H10N2O138.169-1.7412
1000017-97-9nonenonenoneC10H11N3O2205.216-1.3937
100-49-2nonenonenoneC7H14O114.187-9.3679
100-82-3nonenonenoneC7H8NF125.146-3.4112
100-71-0nonenonenoneC7H9N107.155-2.2725
017257-81-7nonenonenoneC6H10O2114.1430.9106
1000339-22-9nonenonenoneC8H5NO4F2217.127-8.0943
1000289-40-6nonenonenoneC7H4N2Br2S307.997-2.2608
100-11-8lowhighnoneC7H6NO2Br216.034-13.162
1000339-25-2nonenonenoneC14H8N2OBrF319.133-1.9975
1000-05-1nonenonehighC8H26O3Si4282.635-83.299
100-21-0highnonehighC8H6O4166.132-1.8442
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
100-46-9nonenonenoneC7H9N107.155-2.0712
1000-22-2lowhighlowC6H14O2FPS200.213-11.052
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
1000-69-7highnonelowC7H18SSn252.996-9.6969
10-13-2009nonenonenoneC15H14O5274.271-1.4702
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
1000058-38-7nonenonenoneC11H12N2O2204.228-4.6529
100-01-6nonenonenoneC6H6N2O2138.126-7.2389
1000018-06-3nonenonenoneC8H8N3Br226.0770.34749
100018-96-0highhighnoneC20H39O2I438.428-31.232
1000304-40-4nonenonenoneC11H17NO179.2622.2651
1000068-23-4nonelownoneC14H18NO5B291.11-44.603
1000296-70-7nonenonenoneC19H27NO7S3477.6213.1322
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
1000-86-8nonenonenoneC7H1296.1723-10.397
100-14-1highhighlowC7H6NO2Cl171.583-7.5061
1000000-13-4highhighhighC21H28O12472.441-0.17986
1000-43-7highhighhighC8H18Cl2Si213.223-31.848
1000166-63-1nonehighnoneC20H23N8O2Br487.361-0.90793
10003-67-5nonenonenoneC33H62O6554.849-22.973
1000025-93-3nonenonenoneC20H17NO4335.358-1.6731
100004-54-4nonehighnoneC4H8Te183.708-3.9699
1000018-50-7nonenonenoneC13H16N2O4264.28-7.3568
100011-01-6nonenonenoneC9H18O2158.24-2.3462
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
100-87-8nonenonenoneC7H8O3S172.204-10.732
100-28-7highlowlowC7H4N2O3164.12-21.552
100-73-2highnonenoneC6H8O2112.128-6.3422
10003-95-9nonenonenoneC10H18N2O17P4562.146-25.989
1000171-05-0nonenonenoneC27H37O3P440.562-24.592
100-07-2highhighlowC8H7O2Cl170.595-10.49
100-92-5nonenonenoneC11H17N163.2631.1672