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5814 20 0 | Cheminformatics

Chemical : Tetramethyl arsonium iodide

Casrn : 5814-20-0

MolName : Tetramethyl arsonium iodide

MolecularFormula : I.C4H12As

Smiles : C[As+](C)(C)C.[I-]

InChI : InChI=1S/C4H12As.HI/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1

InChIK : KEFJVVFCFZNVQM-UHFFFAOYSA-M

CanonicalSyTyLFy : 36d3fe9cc10261a0

TotalMolweight : 261.961

Molweight : 135.061

MonoisotopicMass : 135.015494

CLogP : 2.7868

CLogS : -1.29

TotalSurfaceArea : 76.04

Druglikeness : -2.3575

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : unwanted atom

Shape Index : 0.6

Molecular Complexity : 0.54931

Fragments : 2

Non HAtoms : 5

NonCHAtoms : 1

Electronegative Atoms : 1

Sp3Atoms : 4

Symmetricatoms : 3

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
1000339-24-1nonenonenoneC7H4NOF137.113-7.3916
100019-64-5nonenonenoneC9H10N2O7FP308.157-34.083
1000-28-8nonenonenoneC6H3OF11300.067-44.343
1000269-71-5nonenonehighC12H18N2O2222.287-10.925
100021-79-2nonehighhighC16H32O2.C2H8N2256.428-25.216
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
1000-57-3highnonelowC6H16SSn238.969-7.4261
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
10002-37-6nonenonenoneC9H16N2O168.239-3.8085
10001-46-4nonenonenoneC9H11N3O3209.2041.9565
1000160-75-7nonenonelowC14H17O2BS260.164-20.35
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
100-99-2nonenonelowC12H27Al198.328-22.009
1000339-23-0nonenonenoneC6H5N2O2Br217.022-3.3311
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
1000339-51-4nonenonenoneC7H4NO4F185.11-8.2861
10003-95-9nonenonenoneC10H18N2O17P4562.146-25.989
100003-81-4highhighnoneC8H7N2OClS214.6761.4208
100-58-3nonenonenoneBr.C6H5Mg101.411-2.3575
100-18-5nonenonenoneC12H18162.275-2.5088
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
1000339-30-9nonenonenoneC8H10N3Cl183.6412.1
100012-67-7highhighhighC12H12O5236.222-19.846
100-05-0nonenonenoneCl.C6H4N3O2150.117-9.1371
100-32-3nonenonenoneC12H8N2O4S2308.338-7.3436
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
1000339-33-2nonenonenoneC10H11NClF199.6550.76
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100-26-5nonenonenoneC7H5NO4167.12-1.5746
100-61-8highnonenoneC7H9N107.155-0.23765
100-01-6nonenonenoneC6H6N2O2138.126-7.2389
100019-40-7nonenonenoneC14H15NO3245.277-1.947
1000339-34-3nonenonenoneC11H12N3OBr282.14-5.9074
1000-91-5nonenonehighC5H14OSi118.251-35.679
100031-92-3nonenonehighC10H30OSi4278.691-53.619
100-44-7highhighnoneC7H7Cl126.586-2.365
1000-68-6nonenonenoneC3H9NO3S2171.24-3.0843
100-22-1highhighnoneC10H16N2164.2510.40939
100031-88-7nonenonehighC10H30O3Si4310.689-53.619
1000339-26-3nonenonenoneC14H7N2OBrCl2370.033-0.59356
100-06-1nonenonenoneC9H10O2150.176-1.6836
1000-23-3highhighlowC4H6O4Cl2Sn307.704-8.6766
100021-47-4nonenonenoneC13H17N5O6339.307-2.7249
1000269-68-0nonenonenoneC14H24N4248.3730.99367
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
100004-92-0nonenonenoneC16H11NO2249.268-1.5746
1000198-80-0nonenonenoneC11H14NF179.237-0.04876
1000-16-4nonenonenoneC13H30NO3P279.359-34.244
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
100-70-9nonenonenoneC6H4N2104.112-6.0498
1000304-40-4nonenonenoneC11H17NO179.2622.2651
100-89-0nonenonelowC18H36O6B2370.1-16.157
1000339-45-6nonenonehighC8H14O2F2180.193-28.199
100018-96-0highhighnoneC20H39O2I438.428-31.232
100031-98-9nonenonehighC12H29O4F3Si4406.696-100.78
017257-81-7nonenonenoneC6H10O2114.1430.9106
100-71-0nonenonenoneC7H9N107.155-2.2725
100007-54-3nonenonenoneC28H30O13574.533-1.9839