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62485 90 9 | Cheminformatics

Chemical : Iodomanganese(1+) 2-methylpropan-2-ide

Casrn : 62485-90-9

MolName : Iodomanganese(1+) 2-methylpropan-2-ide

MolecularFormula : IMn.C4H9

Smiles : C[C-](C)C.[Mn+]I

InChI : InChI=1S/C4H9.HI.Mn/c1-4(2)3;;/h1-3H3;1H;/q-1;;+2/p-1

InChIK : GPMWIQHSVPCJML-UHFFFAOYSA-M

CanonicalSyTyLFy : 2788aed2d59c57f4

TotalMolweight : 238.953

Molweight : 57.1155

MonoisotopicMass : 57.070425

CLogP : 1.4658

CLogS : -1.414

TotalSurfaceArea : 57.03

Druglikeness : -2.3575

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.75

Fragments : 2

Non HAtoms : 4

Sp3Atoms : 4

Symmetricatoms : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-90-3nonenonenoneC14H16N4O3S320.3724.7301
1000339-22-9nonenonenoneC8H5NO4F2217.127-8.0943
100-29-8nonenonenoneC8H9NO3167.163-8.928
100-20-9highnonelowC8H4O2Cl2203.024-10.706
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
100004-80-6nonenonenoneC13H11NO3229.234-1.3547
10001-08-8nonenonehighC11H22N2O198.309-3.1037
100031-88-7nonenonehighC10H30O3Si4310.689-53.619
100013-07-8nonenonenoneC18H32B.Li259.263-11.013
1000068-26-7nonenonenoneC13H15NO4BF279.074-46.077
100007-62-3nonenonehighC8H13NO139.197-8.1398
1000303-67-2nonenonenoneC6H8N2O124.1432.717
100-69-6nonenonenoneC7H7N105.14-4.4598
100011-00-5nonenonenoneC15H24O2236.354-18.044
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
100-82-3nonenonenoneC7H8NF125.146-3.4112
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
100009-88-9nonenonenoneC18H45N7359.604-4.1108
1000-87-9nonenonenoneC7H1296.1723-2.6557
1000-82-4lowhighhighC2H6N2O290.08160.41759
100-18-5nonenonenoneC12H18162.275-2.5088
1000339-32-1nonenonenoneC11H14NF179.2370.6275
100009-99-2lowhighnoneC21H25NO4355.4332.9337
100-56-1highlowlowC6H5ClHg313.149-2.3575
1000068-23-4nonelownoneC14H18NO5B291.11-44.603
1000279-69-5nonenonenoneC20H19N2O3ClS402.9015.7907
100-09-4nonenonenoneC8H8O3152.149-1.597
1000335-27-2nonenonenoneC10H15N4OCl242.7090.81574
100-57-2highlowlowC6H6OHg294.703-2.3891
1000018-48-3nonenonenoneC12H15NO4S269.321.5148
100-76-5nonenonehighC7H13N111.1873.5517
1000339-26-3nonenonenoneC14H7N2OBrCl2370.033-0.59356
100-91-4nonenonehighC17H25NO3291.393.3475
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
1000018-59-6nonenonelowC10H15O2BrS279.197-14.078
100021-46-3nonenonenoneC9H11NO2165.191-3.1955
100-75-4highhighhighC5H10N2O114.147-0.86877
100-77-6nonenonenoneC6H4N2Cl.Cl139.565-4.1248
100-85-6nonenonenoneHO.C10H16N150.244-2.6575
100021-84-9highhighhighH3O4P.C18H36O2.C2H8N2284.482-25.216
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
1000018-56-3nonenonenoneC7H4N3O2Br242.032-0.39052
1000339-34-3nonenonenoneC11H12N3OBr282.14-5.9074
1000339-30-9nonenonenoneC8H10N3Cl183.6412.1
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
100-16-3lowhighnoneC6H7N3O2153.141-9.8627
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
100021-82-7nonenonenoneH3O4P.C18H38N2O298.513-22.282
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
1000-50-6nonenonehighC6H15ClSi150.724-84.768
100-74-3highnonehighC6H13NO115.1753.7593
1000-58-4highhighhighC4H8Cl4Si226.006-54.611
100020-34-6nonenonenoneC13H18S2238.418-0.23079
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
100-48-1nonenonenoneC6H4N2104.112-6.0498
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100-81-2nonenonenoneC8H11N121.182-2.1005
100-93-6highhighhighC19H18N2O2S338.43-12.848
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988