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1000 70 0 | Cheminformatics

Chemical : Silanamine, N,N'-methanetetraylbis[1,1,1-trimethyl-

Casrn : 1000-70-0

MolName : Silanamine, N,N'-methanetetraylbis[1,1,1-trimethyl-

MolecularFormula : C7H18N2Si2

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

InChI : InChI=1S/C7H18N2Si2/c1-10(2,3)8-7-9-11(4,5)6/h1-6H3

InChIK : KSVMTHKYDGMXFJ-UHFFFAOYSA-N

CanonicalSyTyLFy : 227d6bb32218a1c8

TotalMolweight : 186.406

Molweight : 186.406

MonoisotopicMass : 186.100852

CLogP : 4.1802

CLogS : -1.67

H Acceptors : 2

TotalSurfaceArea : 149.6

Relative PSA : 0.15388

PolarSurfaceArea : 24.72

Druglikeness : -43.673

Mutagenic : none

Tumorigenic : low

Reproductive Effective : none

Irritant : high

Nasty Functions : isocyanate type

Shape Index : 0.63636

Molecula Flexibility : 0.63146

Molecular Complexity : 0.32189

Fragments : 1

Non HAtoms : 11

NonCHAtoms : 4

Electronegative Atoms : 2

StereoCenters : 1

Rotatable Bond : 2

Sp3Atoms : 6

Symmetricatoms : 7

BasicNitrogens : 2

StereoCon : racemate

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100005-68-3nonenonenoneC13H12O4232.234-4.9451
1000-68-6nonenonenoneC3H9NO3S2171.24-3.0843
1000339-51-4nonenonenoneC7H4NO4F185.11-8.2861
100-70-9nonenonenoneC6H4N2104.112-6.0498
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
100-79-8nonelownoneC6H12O3132.158-9.8672
1000018-13-2nonenonenoneC11H14NO2Br272.141-5.4951
1000-40-4highnonelowC10H24S2Sn327.143-7.0269
10003-67-5nonenonenoneC33H62O6554.849-22.973
100019-40-7nonenonenoneC14H15NO3245.277-1.947
1000269-67-9nonenonenoneC13H22N4234.3460.99367
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
100010-99-9nonenonenoneC11H24O2188.31-23.185
100-04-9nonehighnoneCl.C8H10N3148.188-2.0275
100012-67-7highhighhighC12H12O5236.222-19.846
100-09-4nonenonenoneC8H8O3152.149-1.597
100022-13-7nonenonenoneHCl.C20H21NO4339.392.3133
1000017-97-9nonenonenoneC10H11N3O2205.216-1.3937
1000304-40-4nonenonenoneC11H17NO179.2622.2651
100-39-0highhighnoneC7H7Br171.037-7.8241
1000289-40-6nonenonenoneC7H4N2Br2S307.997-2.2608
1000000-13-4highhighhighC21H28O12472.441-0.17986
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
100003-85-8highhighnoneC13H8N2OCl2S311.1921.0858
100004-92-0nonenonenoneC16H11NO2249.268-1.5746
100-45-8nonenonehighC7H9N107.155-10.018
1000339-52-5nonenonenoneC7H3N2O2F166.111-12.761
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
100-97-0highhighhighC6H12N4140.1891.5849
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
1000296-70-7nonenonenoneC19H27NO7S3477.6213.1322
100009-88-9nonenonenoneC18H45N7359.604-4.1108
1000018-06-3nonenonenoneC8H8N3Br226.0770.34749
100-49-2nonenonenoneC7H14O114.187-9.3679
1000018-10-9nonenonenoneC7H8N2OBr2295.962-5.2121
1000017-92-4nonenonenoneC6H4NBr2Cl285.366-3.6
100-77-6nonenonenoneC6H4N2Cl.Cl139.565-4.1248
017257-81-7nonenonenoneC6H10O2114.1430.9106
1000-69-7highnonelowC7H18SSn252.996-9.6969
100009-01-6nonenonenoneC15H13N3O3283.286-2.3895
100-46-9nonenonenoneC7H9N107.155-2.0712
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
10003-94-8nonenonenoneC9H16N2O18P4564.118-31.509
100004-81-7nonenonenoneC13H11NO3229.234-1.3547
10001-30-6nonenonenoneC17H14O4282.294-0.8408
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
100-14-1highhighlowC7H6NO2Cl171.583-7.5061
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
100-56-1highlowlowC6H5ClHg313.149-2.3575
100020-34-6nonenonenoneC13H18S2238.418-0.23079
1000-57-3highnonelowC6H16SSn238.969-7.4261
100-68-5nonenonenoneC7H8S124.207-1.735
100005-12-7nonenonelowC11H10NCl191.662.2675
100-91-4nonenonehighC17H25NO3291.393.3475
100033-28-1lownonehighC6H9N7179.186-2.3035
10001-08-8nonenonehighC11H22N2O198.309-3.1037
100-27-6lownonenoneC8H9NO3167.163-9.2735
1000018-22-3nonenonenoneC16H22N3O4Br400.272-33.051
100-52-7highhighhighC7H6O106.124-4.225
100-90-3nonenonenoneC14H16N4O3S320.3724.7301