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51199 85 0 | Cheminformatics

Chemical : Dinitrilodigermoxane

Casrn : 51199-85-0

MolName : Dinitrilodigermoxane

MolecularFormula : N2OGe2

Smiles : N#[Ge]O[Ge]#N

InChI : InChI=1S/Ge2N2O/c3-1-5-2-4

InChIK : BHVMAFDNFMTYLQ-UHFFFAOYSA-N

CanonicalSyTyLFy : 21eb379c2ea46f4a

TotalMolweight : 189.233

Molweight : 189.233

MonoisotopicMass : 191.843417

CLogS : -1.962

H Acceptors : 3

TotalSurfaceArea : 37.12

Relative PSA : 1

PolarSurfaceArea : 56.81

Druglikeness : -1.9719

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : unwanted atom

Shape Index : 1

Molecula Flexibility : 0.78535

Molecular Complexity : 0.54931

Fragments : 1

Non HAtoms : 5

NonCHAtoms : 5

Electronegative Atoms : 3

Rotatable Bond : 2

Sp3Atoms : 1

Symmetricatoms : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100021-81-6nonenonenoneH3O4P.C20H42N2O326.566-22.282
100-09-4nonenonenoneC8H8O3152.149-1.597
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
100010-00-2nonenonenoneC20H23NO5357.405-3.7157
100005-12-7nonenonelowC11H10NCl191.662.2675
1000296-71-8nonenonehighC19H27NO8S3493.62-2.9952
100009-01-6nonenonenoneC15H13N3O3283.286-2.3895
100031-76-3nonenonenoneC30H44NO8P577.652-46.719
1000-43-7highhighhighC8H18Cl2Si213.223-31.848
1000160-96-2nonenonenoneC24H28N2O3.C2H4O2392.4971.9926
100-51-6highhighhighC7H8O108.14-2.2456
1000018-39-2highhighlowC13H20N2O2S268.381.9315
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
100007-57-6nonenonenoneC72H113N19O24S61821.19-13.821
100-16-3lowhighnoneC6H7N3O2153.141-9.8627
100-73-2highnonenoneC6H8O2112.128-6.3422
1000-00-6nonenonehighC10H26OSi2218.487-62.76
100-45-8nonenonehighC7H9N107.155-10.018
1000339-45-6nonenonehighC8H14O2F2180.193-28.199
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
100-41-4highhighhighC8H10106.167-2.68
100007-54-3nonenonenoneC28H30O13574.533-1.9839
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885
1000018-06-3nonenonenoneC8H8N3Br226.0770.34749
100-48-1nonenonenoneC6H4N2104.112-6.0498
1000068-23-4nonelownoneC14H18NO5B291.11-44.603
1000269-67-9nonenonenoneC13H22N4234.3460.99367
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
1000152-84-0nonenonenoneC6H2NBr2F3304.891-10.75
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
1000-78-8highlownoneC11H24N2184.326-10.254
100-57-2highlowlowC6H6OHg294.703-2.3891
100-38-9nonenonehighC6H15NS133.2580.17671
10003-95-9nonenonenoneC10H18N2O17P4562.146-25.989
100-65-2highnonenoneC6H7NO109.128-1.548
1000-36-8nonenonenoneC11H25O3P236.29-27.011
100-76-5nonenonehighC7H13N111.1873.5517
1000-46-0nonenonenoneC7H18Ge174.83-4.6976
100-85-6nonenonenoneHO.C10H16N150.244-2.6575
100-83-4highnonelowC7H6O2122.123-4.1407
100-96-9highnonenoneC7H10N2O138.169-1.7412
1000-83-5lowhighhighC2H6N2OS106.149-2.264
100010-02-4nonenonenoneC14H23NO221.343-6.1109
100-00-5nonenonenoneC6H4NO2Cl157.556-7.4592
100-81-2nonenonenoneC8H11N121.182-2.1005
1000339-23-0nonenonenoneC6H5N2O2Br217.022-3.3311
1000269-66-8nonenonenoneC12H20N4220.3190.5423
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
100005-44-5highnonelowC7H5O2ClS188.634-11.771
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
1000339-36-5nonenonenoneC16H19NO3S305.397-3.4866
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
100002-29-7nonenonenoneC12H18N2O3238.2862.8956
100-95-8nonenonenoneCl.C23H41N2O361.592-17.647
100-47-0highnonehighC7H5N103.124-6.0498
10001-52-2highhighnoneC11H10N6O3S306.3056.7202
100020-94-8highnonelowC12H17OCl212.719-11.962
100018-96-0highhighnoneC20H39O2I438.428-31.232