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26750 66 3 | Cheminformatics

Chemical : Potassium thiocarbonate

Casrn : 26750-66-3

MolName : Potassium thiocarbonate

MolecularFormula : K.K.CO2S

Smiles : [O-]C([O-])=S.[K+].[K+]

InChI : InChI=1S/CH2O2S.2K/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2

InChIK : VEQXRZUFKLEXKC-UHFFFAOYSA-L

CanonicalSyTyLFy : 34fca45c545d8f32

TotalMolweight : 154.271

Molweight : 76.075

MonoisotopicMass : 75.9619

CLogP : -4.2791

CLogS : -0.73

H Acceptors : 2

TotalSurfaceArea : 61.27

Relative PSA : 0.92313

PolarSurfaceArea : 78.21

Druglikeness : -2.535

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.75

Fragments : 3

Non HAtoms : 4

NonCHAtoms : 3

Electronegative Atoms : 3

Sp3Atoms : 3

Symmetricatoms : 1

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
100-32-3nonenonenoneC12H8N2O4S2308.338-7.3436
10-13-2009nonenonenoneC15H14O5274.271-1.4702
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
100-61-8highnonenoneC7H9N107.155-0.23765
100023-32-3highhighnoneCH3O4S.C20H19N2O303.3840.7545
10003-69-7nonenonenoneC10H14O8S4390.4770.2775
1000-67-5nonenonehighC4H9O4S.Na153.177-10.412
1000-41-5nonenonelowC10H18O154.252-9.05
1000-86-8nonenonenoneC7H1296.1723-10.397
10002-37-6nonenonenoneC9H16N2O168.239-3.8085
100-39-0highhighnoneC7H7Br171.037-7.8241
100031-88-7nonenonehighC10H30O3Si4310.689-53.619
1000296-70-7nonenonenoneC19H27NO7S3477.6213.1322
10003-94-8nonenonenoneC9H16N2O18P4564.118-31.509
100-92-5nonenonenoneC11H17N163.2631.1672
100-02-7nonenonenoneC6H5NO3139.11-7.5665
100-23-2nonehighnoneC8H10N2O2166.179-5.0759
100-82-3nonenonenoneC7H8NF125.146-3.4112
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
100-48-1nonenonenoneC6H4N2104.112-6.0498
100-51-6highhighhighC7H8O108.14-2.2456
100009-23-2nonenonehighC17H22226.362-9.7346
1000-69-7highnonelowC7H18SSn252.996-9.6969
100020-94-8highnonelowC12H17OCl212.719-11.962
1000018-59-6nonenonelowC10H15O2BrS279.197-14.078
100-28-7highlowlowC7H4N2O3164.12-21.552
1000-70-0nonelowhighC7H18N2Si2186.406-43.673
100021-46-3nonenonenoneC9H11NO2165.191-3.1955
100021-81-6nonenonenoneH3O4P.C20H42N2O326.566-22.282
100-73-2highnonenoneC6H8O2112.128-6.3422
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
100005-01-4nonenonehighC8H21BrSSi2285.397-52.815
1000-36-8nonenonenoneC11H25O3P236.29-27.011
100-81-2nonenonenoneC8H11N121.182-2.1005
100-87-8nonenonenoneC7H8O3S172.204-10.732
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988
1000269-67-9nonenonenoneC13H22N4234.3460.99367
100009-99-2lowhighnoneC21H25NO4355.4332.9337
1000289-40-6nonenonenoneC7H4N2Br2S307.997-2.2608
100007-67-8highnonelowC5H7OClF2156.559-12.702
1000-58-4highhighhighC4H8Cl4Si226.006-54.611
1000000-13-4highhighhighC21H28O12472.441-0.17986
1000-22-2lowhighlowC6H14O2FPS200.213-11.052
100-01-6nonenonenoneC6H6N2O2138.126-7.2389
10003-67-5nonenonenoneC33H62O6554.849-22.973
100016-73-7highhighhighC6H5OCl.C10H16O.CH2O152.236-3.7075
100001-06-7nonenonenoneI.C20H28NO298.448-2.3411
1000018-58-5nonenonenoneC6H4NBr2Cl285.366-3.6
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
1000-77-7highhighnoneHCl.C6H15NO6S2261.3181.5333
100004-54-4nonehighnoneC4H8Te183.708-3.9699
1000018-51-8nonenonenoneC10H10N2O2S2254.3331.3137
100002-29-7nonenonenoneC12H18N2O3238.2862.8956
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
1000160-96-2nonenonenoneC24H28N2O3.C2H4O2392.4971.9926
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
100007-87-2nonenonenoneC16H9N2OBr325.1640.88714