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142573 04 4 | Cheminformatics

Chemical : (2,4,6-Trimethylphenyl)[2,4,6-tri(propan-2-yl)phenyl]germane

Casrn : 142573-04-4

MolName : (2,4,6-Trimethylphenyl)[2,4,6-tri(propan-2-yl)phenyl]germane

MolecularFormula : C24H34Ge

Smiles : CC(C)c(cc1C(C)C)cc(C(C)C)c1[Ge]c1c(C)cc(C)cc1C

InChI : InChI=1S/C24H36Ge/c1-14(2)20-12-21(15(3)4)24(22(13-20)16(5)6)25-23-18(8)10-17(7)11-19(23)9/h10-16H,25H2,1-9H3

InChIK : HAIWGEAEJQBESR-UHFFFAOYSA-N

CanonicalSyTyLFy : 592d8d14b957eea6

TotalMolweight : 395.144

Molweight : 395.144

MonoisotopicMass : 396.187227

CLogP : 7.3587

CLogS : -5.985

TotalSurfaceArea : 280.86

Druglikeness : -2.5088

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : unwanted atom

Shape Index : 0.48

Molecula Flexibility : 0.40948

Molecular Complexity : 0.73783

Fragments : 1

Non HAtoms : 25

NonCHAtoms : 1

Rotatable Bond : 5

Rings Closures : 2

Small Rings : 2

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 12

Symmetricatoms : 10

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-91-4nonenonehighC17H25NO3291.393.3475
100008-89-7nonenonenoneC11H10N4O3246.225-1.8465
1000296-71-8nonenonehighC19H27NO8S3493.62-2.9952
10001-43-1nonenonenoneC15H18N6O2314.3484.1828
10003-94-8nonenonenoneC9H16N2O18P4564.118-31.509
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
100-15-2nonehighnoneC7H8N2O2152.153-5.7806
100-56-1highlowlowC6H5ClHg313.149-2.3575
100-65-2highnonenoneC6H7NO109.128-1.548
100-25-4nonenonenoneC6H4N2O4168.108-7.74
100-94-7nonenonenoneCl.C16H20N226.342-1.9788
100-13-0nonenonelowC8H7NO2149.149-10.212
1000269-71-5nonenonehighC12H18N2O2222.287-10.925
100019-64-5nonenonenoneC9H10N2O7FP308.157-34.083
100009-23-2nonenonehighC17H22226.362-9.7346
1000-22-2lowhighlowC6H14O2FPS200.213-11.052
1000-50-6nonenonehighC6H15ClSi150.724-84.768
1000339-30-9nonenonenoneC8H10N3Cl183.6412.1
1000339-51-4nonenonenoneC7H4NO4F185.11-8.2861
10001-46-4nonenonenoneC9H11N3O3209.2041.9565
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
1000000-13-4highhighhighC21H28O12472.441-0.17986
1000068-42-7nonenonenoneC10H11NO3BrFS324.169-2.2263
100-22-1highhighnoneC10H16N2164.2510.40939
1000304-40-4nonenonenoneC11H17NO179.2622.2651
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
1000-84-6nonenonehighC4H9NO87.1215-6.3779
1000-41-5nonenonelowC10H18O154.252-9.05
100-29-8nonenonenoneC8H9NO3167.163-8.928
1000018-10-9nonenonenoneC7H8N2OBr2295.962-5.2121
1000339-52-5nonenonenoneC7H3N2O2F166.111-12.761
100-66-3highnonehighC7H8O108.14-2.0846
100020-94-8highnonelowC12H17OCl212.719-11.962
1000-44-8highhighlowC7H7Cl126.586-8.5908
1000017-98-0nonenonenoneC8H4N2O2BrCl275.489-2.5326
017257-81-7nonenonenoneC6H10O2114.1430.9106
1000-00-6nonenonehighC10H26OSi2218.487-62.76
10001-08-8nonenonehighC11H22N2O198.309-3.1037
100005-01-4nonenonehighC8H21BrSSi2285.397-52.815
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
1000018-49-4nonenonenoneC14H19NO5S313.3732.5797
1000339-24-1nonenonenoneC7H4NOF137.113-7.3916
1000269-65-7nonenonenoneC12H19N3205.3040.25629
10001-51-1nonenonenoneC9H18N2O170.2555.9677
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
100-17-4nonenonenoneC7H7NO3153.137-7.2945
1000269-68-0nonenonenoneC14H24N4248.3730.99367
100009-92-5nonenonenoneC20H23NO4341.4064.6216
100005-12-7nonenonelowC11H10NCl191.662.2675
1000339-13-8lownonelowC7H10NO4ClS239.678-21.883
1000269-51-1nonenonenoneC13H12NO4B257.052-12.285
1000-82-4lowhighhighC2H6N2O290.08160.41759
100-62-9lownonenoneC7H7N105.14-1.1924
100-19-6nonenonenoneC8H7NO3165.148-7.0365
100027-90-5highhighnoneC20H26N2Cl2.HCl.HCl365.3464.1664
1000269-66-8nonenonenoneC12H20N4220.3190.5423
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
100-38-9nonenonehighC6H15NS133.2580.17671
1000068-26-7nonenonenoneC13H15NO4BF279.074-46.077
1000018-13-2nonenonenoneC11H14NO2Br272.141-5.4951