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72076 37 0 | Cheminformatics

Chemical : Diazen-2-ium-1-ide

Casrn : 72076-37-0

MolName : Diazen-2-ium-1-ide

MolecularFormula : N2

Smiles : N#N

InChI : InChI=1S/N2/c1-2

InChIK : IJGRMHOSHXDMSA-UHFFFAOYSA-N

CanonicalSyTyLFy : eff649a88f852346

TotalMolweight : 28.014

Molweight : 28.014

MonoisotopicMass : 28.006148

CLogS : -0.53

H Acceptors : 2

TotalSurfaceArea : 27.12

Relative PSA : 1

PolarSurfaceArea : 47.58

Druglikeness : -1.7675

Mutagenic : low

Tumorigenic : low

Reproductive Effective : none

Irritant : high

Nasty Functions :

Shape Index : 1

Fragments : 1

Non HAtoms : 2

NonCHAtoms : 2

Electronegative Atoms : 2

Symmetricatoms : 1

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
1000-50-6nonenonehighC6H15ClSi150.724-84.768
100-20-9highnonelowC8H4O2Cl2203.024-10.706
100-92-5nonenonenoneC11H17N163.2631.1672
1000018-26-7nonenonenoneC16H23NO3277.363-15.052
100009-01-6nonenonenoneC15H13N3O3283.286-2.3895
1000289-40-6nonenonenoneC7H4N2Br2S307.997-2.2608
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
1000339-30-9nonenonenoneC8H10N3Cl183.6412.1
1000010-11-6nonenonenoneC28H44N2O2440.669-21.689
1000339-22-9nonenonenoneC8H5NO4F2217.127-8.0943
1000160-96-2nonenonenoneC24H28N2O3.C2H4O2392.4971.9926
100-55-0nonenonenoneC6H7NO109.128-1.9045
1000-00-6nonenonehighC10H26OSi2218.487-62.76
10002-37-6nonenonenoneC9H16N2O168.239-3.8085
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
100021-46-3nonenonenoneC9H11NO2165.191-3.1955
100011-01-6nonenonenoneC9H18O2158.24-2.3462
100020-34-6nonenonenoneC13H18S2238.418-0.23079
1000017-98-0nonenonenoneC8H4N2O2BrCl275.489-2.5326
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
100-62-9lownonenoneC7H7N105.14-1.1924
100-59-4nonenonenoneCl.C6H5Mg101.411-2.3575
1000339-54-7nonenonenoneC9H7O2F3204.147-11.176
1000-91-5nonenonehighC5H14OSi118.251-35.679
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
100019-40-7nonenonenoneC14H15NO3245.277-1.947
10-00-4nonenonenoneC28H34O8498.57-4.8409
100004-80-6nonenonenoneC13H11NO3229.234-1.3547
100-02-7nonenonenoneC6H5NO3139.11-7.5665
1000000-13-4highhighhighC21H28O12472.441-0.17986
100-76-5nonenonehighC7H13N111.1873.5517
1000296-70-7nonenonenoneC19H27NO7S3477.6213.1322
100017-22-9highhighhighC5H8O2100.117-8.1063
100-25-4nonenonenoneC6H4N2O4168.108-7.74
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
10001-13-5nonenonehighC12H22N2O210.323.9217
100007-57-6nonenonenoneC72H113N19O24S61821.19-13.821
100-85-6nonenonenoneHO.C10H16N150.244-2.6575
100022-13-7nonenonenoneHCl.C20H21NO4339.392.3133
100-57-2highlowlowC6H6OHg294.703-2.3891
100005-79-6nonenonenoneC12H9NS199.276-2.6106
1000018-25-6nonenonenoneC13H24N2O6S336.408-32.405
100-27-6lownonenoneC8H9NO3167.163-9.2735
100-70-9nonenonenoneC6H4N2104.112-6.0498
1000058-38-7nonenonenoneC11H12N2O2204.228-4.6529
10001-46-4nonenonenoneC9H11N3O3209.2041.9565
100019-64-5nonenonenoneC9H10N2O7FP308.157-34.083
1000018-51-8nonenonenoneC10H10N2O2S2254.3331.3137
100-13-0nonenonelowC8H7NO2149.149-10.212
1000198-80-0nonenonenoneC11H14NF179.237-0.04876
100-50-5nonenonehighC7H10O110.155-9.6048
1000339-51-4nonenonenoneC7H4NO4F185.11-8.2861
1000339-45-6nonenonehighC8H14O2F2180.193-28.199
100-69-6nonenonenoneC7H7N105.14-4.4598
100-51-6highhighhighC7H8O108.14-2.2456
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
1000018-10-9nonenonenoneC7H8N2OBr2295.962-5.2121
1000-44-8highhighlowC7H7Cl126.586-8.5908
100-17-4nonenonenoneC7H7NO3153.137-7.2945