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7790 40 1 | Cheminformatics

Chemical : Strontium iodide--water (1/2/6)

Casrn : 7790-40-1

MolName : Strontium iodide--water (1/2/6)

MolecularFormula : I.I.Sr.H2O.H2O.H2O.H2O.H2O.H2O

Smiles : O.O.O.O.O.O.[Sr+2].[I-].[I-]

InChI : InChI=1S/2HI.6H2O.Sr/h2*1H;6*1H2;/q;;;;;;;;+2/p-2

InChIK : PHKVCUKHWRPWMA-UHFFFAOYSA-L

CanonicalSyTyLFy : ff52da794e30f564

TotalMolweight : 449.509

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 : 9

Non HAtoms : 1

NonCHAtoms : 1

Electronegative Atoms : 1

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
10003-73-3nonenonenoneHCl.C7H10N2122.17-2.0712
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
100020-94-8highnonelowC12H17OCl212.719-11.962
100007-57-6nonenonenoneC72H113N19O24S61821.19-13.821
1000339-13-8lownonelowC7H10NO4ClS239.678-21.883
1000-40-4highnonelowC10H24S2Sn327.143-7.0269
1000-36-8nonenonenoneC11H25O3P236.29-27.011
1000-41-5nonenonelowC10H18O154.252-9.05
1000017-98-0nonenonenoneC8H4N2O2BrCl275.489-2.5326
100-27-6lownonenoneC8H9NO3167.163-9.2735
1000018-56-3nonenonenoneC7H4N3O2Br242.032-0.39052
1000018-52-9nonenonenoneC11H12N2O2S2268.361.3179
1000018-40-5lowhighnoneC11H16N2O2S240.3261.4856
1000-43-7highhighhighC8H18Cl2Si213.223-31.848
100-10-7nonehighhighC9H11NO149.192-1.8715
1000339-23-0nonenonenoneC6H5N2O2Br217.022-3.3311
100-81-2nonenonenoneC8H11N121.182-2.1005
100-45-8nonenonehighC7H9N107.155-10.018
1000-91-5nonenonehighC5H14OSi118.251-35.679
1000018-58-5nonenonenoneC6H4NBr2Cl285.366-3.6
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
1000269-67-9nonenonenoneC13H22N4234.3460.99367
1000-50-6nonenonehighC6H15ClSi150.724-84.768
1000-78-8highlownoneC11H24N2184.326-10.254
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
10-18-2004nonenonenoneC6H8OS2160.261-3.1913
100-15-2nonehighnoneC7H8N2O2152.153-5.7806
100011-00-5nonenonenoneC15H24O2236.354-18.044
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
100-33-4nonenonenoneC19H24N4O2340.426-7.2784
100-53-8nonehighhighC7H8S124.207-6.3177
10001-46-4nonenonenoneC9H11N3O3209.2041.9565
100019-40-7nonenonenoneC14H15NO3245.277-1.947
100-79-8nonelownoneC6H12O3132.158-9.8672
10000-51-8nonenonenoneC14H15NO3245.2770.10503
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
1000-44-8highhighlowC7H7Cl126.586-8.5908
100007-67-8highnonelowC5H7OClF2156.559-12.702
10-13-2009nonenonenoneC15H14O5274.271-1.4702
100031-98-9nonenonehighC12H29O4F3Si4406.696-100.78
1000284-35-4nonenonehighC16H24O4280.363-11.936
1000296-70-7nonenonenoneC19H27NO7S3477.6213.1322
1000018-59-6nonenonelowC10H15O2BrS279.197-14.078
10001-51-1nonenonenoneC9H18N2O170.2555.9677
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
1000-16-4nonenonenoneC13H30NO3P279.359-34.244
100021-05-4nonenonenoneC21H28O2312.4510.95307
100008-36-4nonenonenoneC17H22O2258.36-5.6379
1000017-97-9nonenonenoneC10H11N3O2205.216-1.3937
1000068-42-7nonenonenoneC10H11NO3BrFS324.169-2.2263
100003-81-4highhighnoneC8H7N2OClS214.6761.4208
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
100-04-9nonehighnoneCl.C8H10N3148.188-2.0275
100031-76-3nonenonenoneC30H44NO8P577.652-46.719
10003-67-5nonenonenoneC33H62O6554.849-22.973
100005-44-5highnonelowC7H5O2ClS188.634-11.771
1000-67-5nonenonehighC4H9O4S.Na153.177-10.412
100-16-3lowhighnoneC6H7N3O2153.141-9.8627
100005-12-7nonenonelowC11H10NCl191.662.2675