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7778 74 7 | Cheminformatics

Chemical : Potassium perchlorate

Casrn : 7778-74-7

MolName : Potassium perchlorate

MolecularFormula : K.O4Cl

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

InChI : InChI=1S/ClHO4.K/c2-1(3,4)5;/h(H,2,3,4,5);/q;+1/p-1

InChIK : YLMGFJXSLBMXHK-UHFFFAOYSA-M

CanonicalSyTyLFy : 3d83474b04532e87

TotalMolweight : 138.547

Molweight : 99.449

MonoisotopicMass : 98.948512

CLogP : -4.1158

CLogS : 0.448

H Acceptors : 4

TotalSurfaceArea : 75.57

Relative PSA : 0.70663

PolarSurfaceArea : 74.27

Druglikeness : -13.558

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : Cl,Br,I on N,O,P,S,Se,I

Shape Index : 0.6

Molecular Complexity : 0.80472

Fragments : 2

Non HAtoms : 5

NonCHAtoms : 5

Electronegative Atoms : 5

Sp3Atoms : 1

Symmetricatoms : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-81-2nonenonenoneC8H11N121.182-2.1005
100005-68-3nonenonenoneC13H12O4232.234-4.9451
100005-44-5highnonelowC7H5O2ClS188.634-11.771
100-93-6highhighhighC19H18N2O2S338.43-12.848
1000025-59-1nonenonenoneC14H11O3Cl262.691-1.449
100021-46-3nonenonenoneC9H11NO2165.191-3.1955
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
100-28-7highlowlowC7H4N2O3164.12-21.552
1000304-40-4nonenonenoneC11H17NO179.2622.2651
100-21-0highnonehighC8H6O4166.132-1.8442
100-47-0highnonehighC7H5N103.124-6.0498
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
1000-58-4highhighhighC4H8Cl4Si226.006-54.611
100-50-5nonenonehighC7H10O110.155-9.6048
1000284-53-6nonenonehighC18H36O2284.482-15.583
100-06-1nonenonenoneC9H10O2150.176-1.6836
100-87-8nonenonenoneC7H8O3S172.204-10.732
1000339-25-2nonenonenoneC14H8N2OBrF319.133-1.9975
1000018-39-2highhighlowC13H20N2O2S268.381.9315
1000025-92-2nonenonenoneC20H16N2O2316.359-6.3825
1000339-54-7nonenonenoneC9H7O2F3204.147-11.176
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
1000018-26-7nonenonenoneC16H23NO3277.363-15.052
1000018-51-8nonenonenoneC10H10N2O2S2254.3331.3137
100016-58-8nonehighnoneC19H19NO5341.3621.8385
1000018-50-7nonenonenoneC13H16N2O4264.28-7.3568
100009-99-2lowhighnoneC21H25NO4355.4332.9337
1000-82-4lowhighhighC2H6N2O290.08160.41759
100-57-2highlowlowC6H6OHg294.703-2.3891
1000018-58-5nonenonenoneC6H4NBr2Cl285.366-3.6
1000166-63-1nonehighnoneC20H23N8O2Br487.361-0.90793
1000-30-2nonenonehighC9H16O140.225-7.4662
100004-92-0nonenonenoneC16H11NO2249.268-1.5746
100-16-3lowhighnoneC6H7N3O2153.141-9.8627
1000-50-6nonenonehighC6H15ClSi150.724-84.768
100-32-3nonenonenoneC12H8N2O4S2308.338-7.3436
10003-94-8nonenonenoneC9H16N2O18P4564.118-31.509
10003-69-7nonenonenoneC10H14O8S4390.4770.2775
100021-05-4nonenonenoneC21H28O2312.4510.95307
100007-67-8highnonelowC5H7OClF2156.559-12.702
1000-57-3highnonelowC6H16SSn238.969-7.4261
1000269-65-7nonenonenoneC12H19N3205.3040.25629
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
100027-27-8nonenonenoneCH3I.C20H24N2292.4253.4994
1000018-52-9nonenonenoneC11H12N2O2S2268.361.3179
100-46-9nonenonenoneC7H9N107.155-2.0712
1000-22-2lowhighlowC6H14O2FPS200.213-11.052
1000018-40-5lowhighnoneC11H16N2O2S240.3261.4856
1000269-66-8nonenonenoneC12H20N4220.3190.5423
100-27-6lownonenoneC8H9NO3167.163-9.2735
100-40-3nonenonehighC8H12108.183-9.1684
1000018-07-4nonenonenoneC14H13N3O239.2771.9531
1000339-52-5nonenonenoneC7H3N2O2F166.111-12.761
100-64-1highhighnoneC6H11NO113.159-6.4182
1000-86-8nonenonenoneC7H1296.1723-10.397
1000296-71-8nonenonehighC19H27NO8S3493.62-2.9952
1000018-23-4nonenonenoneC12H17N3O3251.2852.8124
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
10000-42-7highhighlowC20H18N4O3362.388-5.7793
100007-54-3nonenonenoneC28H30O13574.533-1.9839