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61753 26 2 | Cheminformatics

Chemical : (2,3-Dimethylpentan-3-yl)(methoxy)dimethylsilane

Casrn : 61753-26-2

MolName : (2,3-Dimethylpentan-3-yl)(methoxy)dimethylsilane

MolecularFormula : C10H24OSi

Smiles : CCC(C)(C(C)C)[Si](C)(C)OC

InChI : InChI=1S/C10H24OSi/c1-8-10(4,9(2)3)12(6,7)11-5/h9H,8H2,1-7H3/t10-/m0/s1

InChIK : QDYNSOVBYODLRM-JTQLQIEISA-N

CanonicalSyTyLFy : c24d4d9a8ea3fabe

TotalMolweight : 188.386

Molweight : 188.386

MonoisotopicMass : 188.159642

CLogP : 3.7054

CLogS : -1.604

H Acceptors : 1

TotalSurfaceArea : 159.49

Relative PSA : 0.0627

PolarSurfaceArea : 9.23

Druglikeness : -68.643

Mutagenic : none

Tumorigenic : low

Reproductive Effective : none

Irritant : high

Nasty Functions :

Shape Index : 0.5

Molecula Flexibility : 0.81161

Molecular Complexity : 0.6271

Fragments : 1

Non HAtoms : 12

NonCHAtoms : 2

Electronegative Atoms : 1

StereoCenters : 1

Rotatable Bond : 4

Sp3Atoms : 11

Symmetricatoms : 2

StereoCon : racemate

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-67-4nonenonenoneK.C6H5O93.1047-2.2548
100027-90-5highhighnoneC20H26N2Cl2.HCl.HCl365.3464.1664
10001-30-6nonenonenoneC17H14O4282.294-0.8408
1000-46-0nonenonenoneC7H18Ge174.83-4.6976
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
100-93-6highhighhighC19H18N2O2S338.43-12.848
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
1000018-06-3nonenonenoneC8H8N3Br226.0770.34749
100021-84-9highhighhighH3O4P.C18H36O2.C2H8N2284.482-25.216
1000339-13-8lownonelowC7H10NO4ClS239.678-21.883
1000-05-1nonenonehighC8H26O3Si4282.635-83.299
1000-91-5nonenonehighC5H14OSi118.251-35.679
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
100017-22-9highhighhighC5H8O2100.117-8.1063
100001-06-7nonenonenoneI.C20H28NO298.448-2.3411
10-18-2004nonenonenoneC6H8OS2160.261-3.1913
1000-82-4lowhighhighC2H6N2O290.08160.41759
100-91-4nonenonehighC17H25NO3291.393.3475
1000269-65-7nonenonenoneC12H19N3205.3040.25629
100018-96-0highhighnoneC20H39O2I438.428-31.232
1000025-59-1nonenonenoneC14H11O3Cl262.691-1.449
100-29-8nonenonenoneC8H9NO3167.163-8.928
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
100013-07-8nonenonenoneC18H32B.Li259.263-11.013
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
100016-73-7highhighhighC6H5OCl.C10H16O.CH2O152.236-3.7075
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
100-22-1highhighnoneC10H16N2164.2510.40939
100-21-0highnonehighC8H6O4166.132-1.8442
100-57-2highlowlowC6H6OHg294.703-2.3891
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
1000-69-7highnonelowC7H18SSn252.996-9.6969
100-04-9nonehighnoneCl.C8H10N3148.188-2.0275
100010-02-4nonenonenoneC14H23NO221.343-6.1109
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
1000018-52-9nonenonenoneC11H12N2O2S2268.361.3179
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
100031-92-3nonenonehighC10H30OSi4278.691-53.619
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
10001-08-8nonenonehighC11H22N2O198.309-3.1037
1000018-49-4nonenonenoneC14H19NO5S313.3732.5797
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
1000279-69-5nonenonenoneC20H19N2O3ClS402.9015.7907
1000339-45-6nonenonehighC8H14O2F2180.193-28.199
1000018-13-2nonenonenoneC11H14NO2Br272.141-5.4951
1000-28-8nonenonenoneC6H3OF11300.067-44.343
1000018-39-2highhighlowC13H20N2O2S268.381.9315
100004-92-0nonenonenoneC16H11NO2249.268-1.5746
1000017-94-6nonenonenoneC8H5N2O2Cl196.5932.9136
100-13-0nonenonelowC8H7NO2149.149-10.212
100005-68-3nonenonenoneC13H12O4232.234-4.9451
1000-30-2nonenonehighC9H16O140.225-7.4662
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
100-85-6nonenonenoneHO.C10H16N150.244-2.6575
100-14-1highhighlowC7H6NO2Cl171.583-7.5061
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100-86-7nonenonenoneC10H14O150.22-2.4187
10003-95-9nonenonenoneC10H18N2O17P4562.146-25.989
100-39-0highhighnoneC7H7Br171.037-7.8241