12006 98 3 | Cheminformatics

Molybdenum boride

Formula:Mo.H6B CAS:12006-98-3

PropertyValue
Casrn12006-98-3
MolNameMolybdenum boride
MolecularFormulaMo.H6B
Smiles[BH6-3].[Mo+6]
InChIInChI=1S/BH6.Mo/h1H6;/q-3;+6
InChIKJJJFCZWBGQEABB-UHFFFAOYSA-N
CanonicalSyTyLFy450fd66e0421a2be
TotalMolweight112.799
Molweight95.94
MonoisotopicMass97.905406
CLogS-0.53
Relative PSANaN
Druglikeness-1
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsunwanted atom
Fragments2
Non HAtoms1
NonCHAtoms1
Metal Atoms1
StereoCon
CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100002-29-7nonenonenoneC12H18N2O3238.2862.8956
1000296-70-7nonenonenoneC19H27NO7S3477.6213.1322
1000-23-3highhighlowC4H6O4Cl2Sn307.704-8.6766
1000160-75-7nonenonelowC14H17O2BS260.164-20.35
100-18-5nonenonenoneC12H18162.275-2.5088
1000017-92-4nonenonenoneC6H4NBr2Cl285.366-3.6
1000018-10-9nonenonenoneC7H8N2OBr2295.962-5.2121
100007-54-3nonenonenoneC28H30O13574.533-1.9839
10001-30-6nonenonenoneC17H14O4282.294-0.8408
100-21-0highnonehighC8H6O4166.132-1.8442
10001-08-8nonenonehighC11H22N2O198.309-3.1037
100009-88-9nonenonenoneC18H45N7359.604-4.1108
100-17-4nonenonenoneC7H7NO3153.137-7.2945
100-63-0highhighnoneC6H8N2108.144-4.3224
100012-49-5nonenonenoneC10H2O4Br4505.738-8.4981
100018-96-0highhighnoneC20H39O2I438.428-31.232
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
100010-00-2nonenonenoneC20H23NO5357.405-3.7157
1000304-40-4nonenonenoneC11H17NO179.2622.2651
1000018-40-5lowhighnoneC11H16N2O2S240.3261.4856
1000339-52-5nonenonenoneC7H3N2O2F166.111-12.761
100-94-7nonenonenoneCl.C16H20N226.342-1.9788
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
1000018-58-5nonenonenoneC6H4NBr2Cl285.366-3.6
100010-21-7nonenonenoneC14H21NO219.327-4.2999
100005-12-7nonenonelowC11H10NCl191.662.2675
100019-64-5nonenonenoneC9H10N2O7FP308.157-34.083
100007-57-6nonenonenoneC72H113N19O24S61821.19-13.821
100021-79-2nonehighhighC16H32O2.C2H8N2256.428-25.216
100-57-2highlowlowC6H6OHg294.703-2.3891
1000-50-6nonenonehighC6H15ClSi150.724-84.768
1000339-32-1nonenonenoneC11H14NF179.2370.6275
100-85-6nonenonenoneHO.C10H16N150.244-2.6575
1000-87-9nonenonenoneC7H1296.1723-2.6557
100-54-9nonenonenoneC6H4N2104.112-6.0498
10002-06-9nonenonenoneC10H8N3ClS237.7142.0874
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988
1000068-42-7nonenonenoneC10H11NO3BrFS324.169-2.2263
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
100-55-0nonenonenoneC6H7NO109.128-1.9045
100021-85-0nonehighhighH3O4P.C16H32O2.C2H8N2256.428-25.216
1000-36-8nonenonenoneC11H25O3P236.29-27.011
10000-51-8nonenonenoneC14H15NO3245.2770.10503
100031-98-9nonenonehighC12H29O4F3Si4406.696-100.78
10003-69-7nonenonenoneC10H14O8S4390.4770.2775
1000339-28-5nonenonenoneC14H8N2OBrCl335.588-0.59356
1000018-23-4nonenonenoneC12H17N3O3251.2852.8124
1000-00-6nonenonehighC10H26OSi2218.487-62.76
100023-32-3highhighnoneCH3O4S.C20H19N2O303.3840.7545
100-90-3nonenonenoneC14H16N4O3S320.3724.7301
100-66-3highnonehighC7H8O108.14-2.0846
100-86-7nonenonenoneC10H14O150.22-2.4187
100-75-4highhighhighC5H10N2O114.147-0.86877
100-14-1highhighlowC7H6NO2Cl171.583-7.5061
100-44-7highhighnoneC7H7Cl126.586-2.365
100021-81-6nonenonenoneH3O4P.C20H42N2O326.566-22.282
10001-51-1nonenonenoneC9H18N2O170.2555.9677
100004-92-0nonenonenoneC16H11NO2249.268-1.5746
100031-76-3nonenonenoneC30H44NO8P577.652-46.719