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54690 66 3 | Cheminformatics

Chemical : (2-Cyclopropylethyl)(trimethyl)silane

Casrn : 54690-66-3

MolName : (2-Cyclopropylethyl)(trimethyl)silane

MolecularFormula : C8H18Si

Smiles : C[Si](C)(C)CCC1CC1

InChI : InChI=1S/C8H18Si/c1-9(2,3)7-6-8-4-5-8/h8H,4-7H2,1-3H3

InChIK : AKOBMXDZXNCZIX-UHFFFAOYSA-N

CanonicalSyTyLFy : 2017746dfbda4651

TotalMolweight : 142.317

Molweight : 142.317

MonoisotopicMass : 142.117777

CLogP : 3.8109

CLogS : -4.367

TotalSurfaceArea : 117.82

Druglikeness : -73.913

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : high

Nasty Functions :

Shape Index : 0.66667

Molecula Flexibility : 0.60973

Molecular Complexity : 0.48648

Fragments : 1

Non HAtoms : 9

NonCHAtoms : 1

Rotatable Bond : 3

Rings Closures : 1

Small Rings : 1

Sp3Atoms : 8

Symmetricatoms : 3

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-16-3lowhighnoneC6H7N3O2153.141-9.8627
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100-33-4nonenonenoneC19H24N4O2340.426-7.2784
100-75-4highhighhighC5H10N2O114.147-0.86877
1000-50-6nonenonehighC6H15ClSi150.724-84.768
100-91-4nonenonehighC17H25NO3291.393.3475
1000-83-5lowhighhighC2H6N2OS106.149-2.264
1000269-66-8nonenonenoneC12H20N4220.3190.5423
100-66-3highnonehighC7H8O108.14-2.0846
100-82-3nonenonenoneC7H8NF125.146-3.4112
100-22-1highhighnoneC10H16N2164.2510.40939
10003-67-5nonenonenoneC33H62O6554.849-22.973
100008-36-4nonenonenoneC17H22O2258.36-5.6379
10003-95-9nonenonenoneC10H18N2O17P4562.146-25.989
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
100005-44-5highnonelowC7H5O2ClS188.634-11.771
1000010-11-6nonenonenoneC28H44N2O2440.669-21.689
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
100-09-4nonenonenoneC8H8O3152.149-1.597
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
100-81-2nonenonenoneC8H11N121.182-2.1005
1000018-50-7nonenonenoneC13H16N2O4264.28-7.3568
100-28-7highlowlowC7H4N2O3164.12-21.552
100004-93-1nonehighnoneC16H11NO2249.268-1.5746
100017-22-9highhighhighC5H8O2100.117-8.1063
1000-91-5nonenonehighC5H14OSi118.251-35.679
1000-46-0nonenonenoneC7H18Ge174.83-4.6976
1000018-23-4nonenonenoneC12H17N3O3251.2852.8124
1000160-96-2nonenonenoneC24H28N2O3.C2H4O2392.4971.9926
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
1000339-27-4nonenonenoneC14H8N3O3Br346.14-5.8142
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
1000025-92-2nonenonenoneC20H16N2O2316.359-6.3825
100027-33-6nonenonenoneI.C21H27N2O323.4583.6949
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
100-32-3nonenonenoneC12H8N2O4S2308.338-7.3436
1000-77-7highhighnoneHCl.C6H15NO6S2261.3181.5333
100010-02-4nonenonenoneC14H23NO221.343-6.1109
1000018-39-2highhighlowC13H20N2O2S268.381.9315
1000-41-5nonenonelowC10H18O154.252-9.05
100-59-4nonenonenoneCl.C6H5Mg101.411-2.3575
100-26-5nonenonenoneC7H5NO4167.12-1.5746
10002-30-9nonenonenoneC12H9NOS215.2750.083087
1000068-26-7nonenonenoneC13H15NO4BF279.074-46.077
100028-43-1nonenonenoneBr.C21H35N2315.523-2.5218
100-70-9nonenonenoneC6H4N2104.112-6.0498
100-96-9highnonenoneC7H10N2O138.169-1.7412
10002-97-8nonenonenoneC18H30O2278.4340.24997
1000339-26-3nonenonenoneC14H7N2OBrCl2370.033-0.59356
1000303-67-2nonenonenoneC6H8N2O124.1432.717
100009-01-6nonenonenoneC15H13N3O3283.286-2.3895
100-61-8highnonenoneC7H9N107.155-0.23765
100023-32-3highhighnoneCH3O4S.C20H19N2O303.3840.7545
100-86-7nonenonenoneC10H14O150.22-2.4187
100-23-2nonehighnoneC8H10N2O2166.179-5.0759
1000198-80-0nonenonenoneC11H14NF179.237-0.04876
100-73-2highnonenoneC6H8O2112.128-6.3422
100-58-3nonenonenoneBr.C6H5Mg101.411-2.3575
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988
100-52-7highhighhighC7H6O106.124-4.225