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638 38 0 | Cheminformatics

Chemical : Manganese(II) acetate

Casrn : 638-38-0

MolName : Manganese(II) acetate

MolecularFormula : Mn.C2H3O2.C2H3O2

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

InChI : InChI=1S/2C2H4O2.Mn/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2

InChIK : UOGMEBQRZBEZQT-UHFFFAOYSA-L

CanonicalSyTyLFy : 36410f46cfb729d2

TotalMolweight : 173.026

Molweight : 59.0438

MonoisotopicMass : 59.013305

CLogP : -2.3751

CLogS : -0.459

H Acceptors : 2

TotalSurfaceArea : 51.04

Relative PSA : 0.53527

PolarSurfaceArea : 40.13

Druglikeness : -6.1723

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.75

Fragments : 3

Non HAtoms : 4

NonCHAtoms : 2

Electronegative Atoms : 2

Sp3Atoms : 2

AcidicOxygens : 1

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
1000269-66-8nonenonenoneC12H20N4220.3190.5423
1000068-26-7nonenonenoneC13H15NO4BF279.074-46.077
100-76-5nonenonehighC7H13N111.1873.5517
100-63-0highhighnoneC6H8N2108.144-4.3224
100004-81-7nonenonenoneC13H11NO3229.234-1.3547
100016-58-8nonehighnoneC19H19NO5341.3621.8385
100-39-0highhighnoneC7H7Br171.037-7.8241
100-83-4highnonelowC7H6O2122.123-4.1407
100-74-3highnonehighC6H13NO115.1753.7593
100004-79-3nonenonenoneC13H11NO2213.235-1.5864
1000303-67-2nonenonenoneC6H8N2O124.1432.717
10001-30-6nonenonenoneC17H14O4282.294-0.8408
017257-81-7nonenonenoneC6H10O2114.1430.9106
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
1000-86-8nonenonenoneC7H1296.1723-10.397
100009-88-9nonenonenoneC18H45N7359.604-4.1108
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
100019-40-7nonenonenoneC14H15NO3245.277-1.947
1000339-29-6nonenonenoneC14H15N2OBr307.19-5.8756
1000018-39-2highhighlowC13H20N2O2S268.381.9315
1000339-13-8lownonelowC7H10NO4ClS239.678-21.883
100005-44-5highnonelowC7H5O2ClS188.634-11.771
1000018-50-7nonenonenoneC13H16N2O4264.28-7.3568
100019-64-5nonenonenoneC9H10N2O7FP308.157-34.083
100018-96-0highhighnoneC20H39O2I438.428-31.232
1000-69-7highnonelowC7H18SSn252.996-9.6969
1000269-71-5nonenonehighC12H18N2O2222.287-10.925
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
100004-54-4nonehighnoneC4H8Te183.708-3.9699
1000304-40-4nonenonenoneC11H17NO179.2622.2651
1000171-05-0nonenonenoneC27H37O3P440.562-24.592
100-45-8nonenonehighC7H9N107.155-10.018
100-46-9nonenonenoneC7H9N107.155-2.0712
100-55-0nonenonenoneC6H7NO109.128-1.9045
100-13-0nonenonelowC8H7NO2149.149-10.212
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
1000-77-7highhighnoneHCl.C6H15NO6S2261.3181.5333
1000000-13-4highhighhighC21H28O12472.441-0.17986
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
1000025-59-1nonenonenoneC14H11O3Cl262.691-1.449
100-49-2nonenonenoneC7H14O114.187-9.3679
100001-06-7nonenonenoneI.C20H28NO298.448-2.3411
100010-02-4nonenonenoneC14H23NO221.343-6.1109
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
100004-94-2nonenonenoneC13H11NO2213.235-1.5864
100-44-7highhighnoneC7H7Cl126.586-2.365
100-66-3highnonehighC7H8O108.14-2.0846
100-94-7nonenonenoneCl.C16H20N226.342-1.9788
10000-51-8nonenonenoneC14H15NO3245.2770.10503
100005-01-4nonenonehighC8H21BrSSi2285.397-52.815
10003-73-3nonenonenoneHCl.C7H10N2122.17-2.0712
1000-91-5nonenonehighC5H14OSi118.251-35.679
100-06-1nonenonenoneC9H10O2150.176-1.6836
1000152-84-0nonenonenoneC6H2NBr2F3304.891-10.75
1000-36-8nonenonenoneC11H25O3P236.29-27.011
100008-90-0nonenonenoneC12H11N3O3245.237-1.9187
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
1000339-36-5nonenonenoneC16H19NO3S305.397-3.4866
1000018-49-4nonenonenoneC14H19NO5S313.3732.5797