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1312 76 1 | Cheminformatics

Chemical : Potassium silicate

Casrn : 1312-76-1

MolName : Potassium silicate

MolecularFormula : K.HO3Si

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

InChI : InChI=1S/K.HO3Si/c;1-4(2)3/h;1H/q+1;-1

InChIK : WMWBFVSTSRDWRL-UHFFFAOYSA-N

CanonicalSyTyLFy : b47bca6ce56b9fa2

TotalMolweight : 116.189

Molweight : 77.0909

MonoisotopicMass : 76.969497

CLogP : 0.3317

CLogS : 2.01

H Acceptors : 3

H Donors : 1

TotalSurfaceArea : 40.42

Relative PSA : 1

PolarSurfaceArea : 60.36

Druglikeness : -8.5357

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : high

Nasty Functions :

Shape Index : 0.75

Fragments : 2

Non HAtoms : 4

NonCHAtoms : 4

Electronegative Atoms : 3

Sp3Atoms : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-07-2highhighlowC8H7O2Cl170.595-10.49
10-00-4nonenonenoneC28H34O8498.57-4.8409
100009-99-2lowhighnoneC21H25NO4355.4332.9337
100016-73-7highhighhighC6H5OCl.C10H16O.CH2O152.236-3.7075
100005-44-5highnonelowC7H5O2ClS188.634-11.771
100-52-7highhighhighC7H6O106.124-4.225
100-74-3highnonehighC6H13NO115.1753.7593
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
1000018-40-5lowhighnoneC11H16N2O2S240.3261.4856
100031-98-9nonenonehighC12H29O4F3Si4406.696-100.78
10-18-2004nonenonenoneC6H8OS2160.261-3.1913
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
1000152-84-0nonenonenoneC6H2NBr2F3304.891-10.75
100-66-3highnonehighC7H8O108.14-2.0846
100-91-4nonenonehighC17H25NO3291.393.3475
1000339-25-2nonenonenoneC14H8N2OBrF319.133-1.9975
1000025-59-1nonenonenoneC14H11O3Cl262.691-1.449
100-04-9nonehighnoneCl.C8H10N3148.188-2.0275
1000-28-8nonenonenoneC6H3OF11300.067-44.343
1000-67-5nonenonehighC4H9O4S.Na153.177-10.412
100-57-2highlowlowC6H6OHg294.703-2.3891
1000166-63-1nonehighnoneC20H23N8O2Br487.361-0.90793
100007-62-3nonenonehighC8H13NO139.197-8.1398
100-16-3lowhighnoneC6H7N3O2153.141-9.8627
10001-13-5nonenonehighC12H22N2O210.323.9217
100027-90-5highhighnoneC20H26N2Cl2.HCl.HCl365.3464.1664
100020-94-8highnonelowC12H17OCl212.719-11.962
1000339-31-0nonenonehighC12H16NCl209.7190.65299
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988
10000-42-7highhighlowC20H18N4O3362.388-5.7793
1000269-68-0nonenonenoneC14H24N4248.3730.99367
100010-00-2nonenonenoneC20H23NO5357.405-3.7157
100003-81-4highhighnoneC8H7N2OClS214.6761.4208
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
100-40-3nonenonehighC8H12108.183-9.1684
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
100-63-0highhighnoneC6H8N2108.144-4.3224
100021-46-3nonenonenoneC9H11NO2165.191-3.1955
100005-68-3nonenonenoneC13H12O4232.234-4.9451
10001-30-6nonenonenoneC17H14O4282.294-0.8408
100-64-1highhighnoneC6H11NO113.159-6.4182
100004-93-1nonehighnoneC16H11NO2249.268-1.5746
100009-88-9nonenonenoneC18H45N7359.604-4.1108
1000339-32-1nonenonenoneC11H14NF179.2370.6275
10003-69-7nonenonenoneC10H14O8S4390.4770.2775
10002-97-8nonenonenoneC18H30O2278.4340.24997
100007-87-2nonenonenoneC16H9N2OBr325.1640.88714
100-96-9highnonenoneC7H10N2O138.169-1.7412
100-47-0highnonehighC7H5N103.124-6.0498
1000-50-6nonenonehighC6H15ClSi150.724-84.768
100-10-7nonehighhighC9H11NO149.192-1.8715
100-58-3nonenonenoneBr.C6H5Mg101.411-2.3575
1000-87-9nonenonenoneC7H1296.1723-2.6557
100023-32-3highhighnoneCH3O4S.C20H19N2O303.3840.7545
100-77-6nonenonenoneC6H4N2Cl.Cl139.565-4.1248
1000303-67-2nonenonenoneC6H8N2O124.1432.717
1000269-67-9nonenonenoneC13H22N4234.3460.99367
100001-06-7nonenonenoneI.C20H28NO298.448-2.3411
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
100-55-0nonenonenoneC6H7NO109.128-1.9045