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15710 66 4 | Cheminformatics

Chemical : Manganese(2+) nitrate--water (1/2/1)

Casrn : 15710-66-4

MolName : Manganese(2+) nitrate--water (1/2/1)

MolecularFormula : Mn.NO3.NO3.H2O

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

InChI : InChI=1S/Mn.2NO3.H2O/c;2*2-1(3)4;/h;;;1H2/q+2;2*-1;

InChIK : HBTFASPVVFSRRI-UHFFFAOYSA-N

CanonicalSyTyLFy : 4110c2bbf072238b

TotalMolweight : 196.961

Molweight : 62.004

MonoisotopicMass : 61.987819

CLogP : -0.8585

CLogS : -1.108

H Acceptors : 4

TotalSurfaceArea : 43.46

Relative PSA : 1

PolarSurfaceArea : 62.89

Druglikeness : -9.919

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.75

Fragments : 4

Non HAtoms : 4

NonCHAtoms : 4

Electronegative Atoms : 4

Sp3Atoms : 2

Symmetricatoms : 1

AcidicOxygens : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
017257-81-7nonenonenoneC6H10O2114.1430.9106
1000-46-0nonenonenoneC7H18Ge174.83-4.6976
1000303-67-2nonenonenoneC6H8N2O124.1432.717
100-50-5nonenonehighC7H10O110.155-9.6048
100-19-6nonenonenoneC8H7NO3165.148-7.0365
1000058-38-7nonenonenoneC11H12N2O2204.228-4.6529
100009-99-2lowhighnoneC21H25NO4355.4332.9337
1000-30-2nonenonehighC9H16O140.225-7.4662
10003-69-7nonenonenoneC10H14O8S4390.4770.2775
100-22-1highhighnoneC10H16N2164.2510.40939
1000339-26-3nonenonenoneC14H7N2OBrCl2370.033-0.59356
1000152-84-0nonenonenoneC6H2NBr2F3304.891-10.75
1000269-66-8nonenonenoneC12H20N4220.3190.5423
1000010-11-6nonenonenoneC28H44N2O2440.669-21.689
100020-34-6nonenonenoneC13H18S2238.418-0.23079
100-69-6nonenonenoneC7H7N105.14-4.4598
100-57-2highlowlowC6H6OHg294.703-2.3891
100-75-4highhighhighC5H10N2O114.147-0.86877
100011-00-5nonenonenoneC15H24O2236.354-18.044
100021-81-6nonenonenoneH3O4P.C20H42N2O326.566-22.282
1000-57-3highnonelowC6H16SSn238.969-7.4261
1000018-50-7nonenonenoneC13H16N2O4264.28-7.3568
1000289-40-6nonenonenoneC7H4N2Br2S307.997-2.2608
100013-07-8nonenonenoneC18H32B.Li259.263-11.013
1000018-70-1nonenonenoneC15H18N2O6322.316-6.5762
100-14-1highhighlowC7H6NO2Cl171.583-7.5061
1000018-56-3nonenonenoneC7H4N3O2Br242.032-0.39052
100020-95-9highnonelowC12H17OCl212.719-11.962
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
100-86-7nonenonenoneC10H14O150.22-2.4187
1000-50-6nonenonehighC6H15ClSi150.724-84.768
1000018-59-6nonenonelowC10H15O2BrS279.197-14.078
1000-70-0nonelowhighC7H18N2Si2186.406-43.673
10001-30-6nonenonenoneC17H14O4282.294-0.8408
10003-42-6nonenonenoneC11H11NO4221.211-4.7046
1000339-23-0nonenonenoneC6H5N2O2Br217.022-3.3311
1000284-35-4nonenonehighC16H24O4280.363-11.936
1000-16-4nonenonenoneC13H30NO3P279.359-34.244
10-00-4nonenonenoneC28H34O8498.57-4.8409
100-25-4nonenonenoneC6H4N2O4168.108-7.74
100-89-0nonenonelowC18H36O6B2370.1-16.157
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
100001-06-7nonenonenoneI.C20H28NO298.448-2.3411
100018-96-0highhighnoneC20H39O2I438.428-31.232
1000017-97-9nonenonenoneC10H11N3O2205.216-1.3937
100-12-9nonenonenoneC8H9NO2151.164-7.7443
100033-28-1lownonehighC6H9N7179.186-2.3035
100008-90-0nonenonenoneC12H11N3O3245.237-1.9187
1000-87-9nonenonenoneC7H1296.1723-2.6557
10002-37-6nonenonenoneC9H16N2O168.239-3.8085
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
100021-05-4nonenonenoneC21H28O2312.4510.95307
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
1000018-07-4nonenonenoneC14H13N3O239.2771.9531
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
1000-68-6nonenonenoneC3H9NO3S2171.24-3.0843
100-53-8nonehighhighC7H8S124.207-6.3177
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
100007-54-3nonenonenoneC28H30O13574.533-1.9839