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7785 87 7 | Cheminformatics

Chemical : Manganese sulfate (1:1)

Casrn : 7785-87-7

MolName : Manganese sulfate (1:1)

MolecularFormula : Mn.O4S

Smiles : [O-]S([O-])(=O)=O.[Mn+2]

InChI : InChI=1S/Mn.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2

InChIK : SQQMAOCOWKFBNP-UHFFFAOYSA-L

CanonicalSyTyLFy : c14b4c9dc4d2d9b9

TotalMolweight : 151

Molweight : 96.062

MonoisotopicMass : 95.95173

CLogP : -5.9055

CLogS : 1.524

H Acceptors : 4

TotalSurfaceArea : 57.14

Relative PSA : 1

PolarSurfaceArea : 88.64

Druglikeness : -10.57

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.6

Molecular Complexity : 0.69315

Fragments : 2

Non HAtoms : 5

NonCHAtoms : 5

Electronegative Atoms : 5

Sp3Atoms : 3

Symmetricatoms : 2

AcidicOxygens : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-90-3nonenonenoneC14H16N4O3S320.3724.7301
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
100-48-1nonenonenoneC6H4N2104.112-6.0498
100-76-5nonenonehighC7H13N111.1873.5517
100009-92-5nonenonenoneC20H23NO4341.4064.6216
1000339-32-1nonenonenoneC11H14NF179.2370.6275
1000284-35-4nonenonehighC16H24O4280.363-11.936
1000018-56-3nonenonenoneC7H4N3O2Br242.032-0.39052
10003-94-8nonenonenoneC9H16N2O18P4564.118-31.509
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
100-20-9highnonelowC8H4O2Cl2203.024-10.706
100-38-9nonenonehighC6H15NS133.2580.17671
10000-42-7highhighlowC20H18N4O3362.388-5.7793
100-28-7highlowlowC7H4N2O3164.12-21.552
100-95-8nonenonenoneCl.C23H41N2O361.592-17.647
100-66-3highnonehighC7H8O108.14-2.0846
1000339-34-3nonenonenoneC11H12N3OBr282.14-5.9074
100-71-0nonenonenoneC7H9N107.155-2.2725
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
100020-83-5nonenonelowC7H11O3B153.972-20.814
1000-05-1nonenonehighC8H26O3Si4282.635-83.299
100021-46-3nonenonenoneC9H11NO2165.191-3.1955
100013-07-8nonenonenoneC18H32B.Li259.263-11.013
100007-57-6nonenonenoneC72H113N19O24S61821.19-13.821
1000068-23-4nonelownoneC14H18NO5B291.11-44.603
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
1000339-24-1nonenonenoneC7H4NOF137.113-7.3916
100031-88-7nonenonehighC10H30O3Si4310.689-53.619
100021-81-6nonenonenoneH3O4P.C20H42N2O326.566-22.282
100021-84-9highhighhighH3O4P.C18H36O2.C2H8N2284.482-25.216
100-52-7highhighhighC7H6O106.124-4.225
1000303-67-2nonenonenoneC6H8N2O124.1432.717
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
1000339-23-0nonenonenoneC6H5N2O2Br217.022-3.3311
1000152-84-0nonenonenoneC6H2NBr2F3304.891-10.75
100009-01-6nonenonenoneC15H13N3O3283.286-2.3895
1000-43-7highhighhighC8H18Cl2Si213.223-31.848
1000058-38-7nonenonenoneC11H12N2O2204.228-4.6529
100027-90-5highhighnoneC20H26N2Cl2.HCl.HCl365.3464.1664
100-68-5nonenonenoneC7H8S124.207-1.735
100-40-3nonenonehighC8H12108.183-9.1684
100008-89-7nonenonenoneC11H10N4O3246.225-1.8465
100-22-1highhighnoneC10H16N2164.2510.40939
100-26-5nonenonenoneC7H5NO4167.12-1.5746
100020-34-6nonenonenoneC13H18S2238.418-0.23079
100-12-9nonenonenoneC8H9NO2151.164-7.7443
1000-58-4highhighhighC4H8Cl4Si226.006-54.611
1000018-26-7nonenonenoneC16H23NO3277.363-15.052
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
100-70-9nonenonenoneC6H4N2104.112-6.0498
1000269-67-9nonenonenoneC13H22N4234.3460.99367
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
100010-02-4nonenonenoneC14H23NO221.343-6.1109
100011-01-6nonenonenoneC9H18O2158.24-2.3462
100-96-9highnonenoneC7H10N2O138.169-1.7412
1000025-59-1nonenonenoneC14H11O3Cl262.691-1.449
100028-43-1nonenonenoneBr.C21H35N2315.523-2.5218
1000-00-6nonenonehighC10H26OSi2218.487-62.76
1000339-25-2nonenonenoneC14H8N2OBrF319.133-1.9975
1000-28-8nonenonenoneC6H3OF11300.067-44.343