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120471 84 3 | Cheminformatics

Chemical : Trisodium triiodide

Casrn : 120471-84-3

MolName : Trisodium triiodide

MolecularFormula : I.I.I.Na.Na.Na

Smiles : [Na+].[Na+].[Na+].[I-].[I-].[I-]

InChI : InChI=1S/3HI.3Na/h3*1H;;;/q;;;3*+1/p-3

InChIK : YFPFNQMIZPDQRR-UHFFFAOYSA-K

CanonicalSyTyLFy : ff52da794e30f564

TotalMolweight : 449.67

Molweight : 126.9

MonoisotopicMass : 126.904473

CLogS : -0.53

TotalSurfaceArea : 33.03

Druglikeness : -2.9075

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Fragments : 6

Non HAtoms : 1

NonCHAtoms : 1

Electronegative Atoms : 1

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100028-43-1nonenonenoneBr.C21H35N2315.523-2.5218
1000018-39-2highhighlowC13H20N2O2S268.381.9315
100016-73-7highhighhighC6H5OCl.C10H16O.CH2O152.236-3.7075
100007-54-3nonenonenoneC28H30O13574.533-1.9839
100011-00-5nonenonenoneC15H24O2236.354-18.044
1000-67-5nonenonehighC4H9O4S.Na153.177-10.412
100-93-6highhighhighC19H18N2O2S338.43-12.848
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
1000-16-4nonenonenoneC13H30NO3P279.359-34.244
1000018-58-5nonenonenoneC6H4NBr2Cl285.366-3.6
100-50-5nonenonehighC7H10O110.155-9.6048
1000-83-5lowhighhighC2H6N2OS106.149-2.264
1000018-59-6nonenonelowC10H15O2BrS279.197-14.078
1000018-23-4nonenonenoneC12H17N3O3251.2852.8124
1000-78-8highlownoneC11H24N2184.326-10.254
1000166-63-1nonehighnoneC20H23N8O2Br487.361-0.90793
100-75-4highhighhighC5H10N2O114.147-0.86877
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
10-13-2009nonenonenoneC15H14O5274.271-1.4702
10002-30-9nonenonenoneC12H9NOS215.2750.083087
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
10003-95-9nonenonenoneC10H18N2O17P4562.146-25.989
1000339-27-4nonenonenoneC14H8N3O3Br346.14-5.8142
100-68-5nonenonenoneC7H8S124.207-1.735
100004-81-7nonenonenoneC13H11NO3229.234-1.3547
100-21-0highnonehighC8H6O4166.132-1.8442
100005-44-5highnonelowC7H5O2ClS188.634-11.771
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100-69-6nonenonenoneC7H7N105.14-4.4598
1000-91-5nonenonehighC5H14OSi118.251-35.679
10-00-4nonenonenoneC28H34O8498.57-4.8409
100-81-2nonenonenoneC8H11N121.182-2.1005
100-65-2highnonenoneC6H7NO109.128-1.548
1000018-70-1nonenonenoneC15H18N2O6322.316-6.5762
1000-43-7highhighhighC8H18Cl2Si213.223-31.848
100-47-0highnonehighC7H5N103.124-6.0498
100020-34-6nonenonenoneC13H18S2238.418-0.23079
100-46-9nonenonenoneC7H9N107.155-2.0712
1000-05-1nonenonehighC8H26O3Si4282.635-83.299
100007-55-4nonenonenoneC35H39O19763.676-1.2907
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
100-26-5nonenonenoneC7H5NO4167.12-1.5746
1000-36-8nonenonenoneC11H25O3P236.29-27.011
10001-30-6nonenonenoneC17H14O4282.294-0.8408
1000198-80-0nonenonenoneC11H14NF179.237-0.04876
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
100-52-7highhighhighC7H6O106.124-4.225
100-48-1nonenonenoneC6H4N2104.112-6.0498
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988
100-45-8nonenonehighC7H9N107.155-10.018
100-73-2highnonenoneC6H8O2112.128-6.3422
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
1000-50-6nonenonehighC6H15ClSi150.724-84.768
1000-57-3highnonelowC6H16SSn238.969-7.4261
100016-58-8nonehighnoneC19H19NO5341.3621.8385
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
1000269-51-1nonenonenoneC13H12NO4B257.052-12.285
1000068-42-7nonenonenoneC10H11NO3BrFS324.169-2.2263
100009-88-9nonenonenoneC18H45N7359.604-4.1108
100003-81-4highhighnoneC8H7N2OClS214.6761.4208