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10099 59 9 | Cheminformatics

Chemical : Nitric acid, lanthanum(3+) salt (3:1)

Casrn : 10099-59-9

MolName : Nitric acid, lanthanum(3+) salt (3:1)

MolecularFormula : La.NO3.NO3.NO3

Smiles : [O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.[La+3]

InChI : InChI=1S/La.3NO3/c;3*2-1(3)4/q+3;3*-1

InChIK : FYDKNKUEBJQCCN-UHFFFAOYSA-N

CanonicalSyTyLFy : 4110c2bbf072238b

TotalMolweight : 324.922

Molweight : 62.004

MonoisotopicMass : 61.987819

CLogP : -0.8585

CLogS : -1.108

H Acceptors : 4

TotalSurfaceArea : 43.46

Relative PSA : 1

PolarSurfaceArea : 62.89

Druglikeness : -9.919

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.75

Fragments : 4

Non HAtoms : 4

NonCHAtoms : 4

Electronegative Atoms : 4

Sp3Atoms : 2

Symmetricatoms : 1

AcidicOxygens : 2

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
1000018-51-8nonenonenoneC10H10N2O2S2254.3331.3137
100012-67-7highhighhighC12H12O5236.222-19.846
1000018-58-5nonenonenoneC6H4NBr2Cl285.366-3.6
1000017-94-6nonenonenoneC8H5N2O2Cl196.5932.9136
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
1000-41-5nonenonelowC10H18O154.252-9.05
100-19-6nonenonenoneC8H7NO3165.148-7.0365
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100004-94-2nonenonenoneC13H11NO2213.235-1.5864
1000018-56-3nonenonenoneC7H4N3O2Br242.032-0.39052
100009-99-2lowhighnoneC21H25NO4355.4332.9337
100007-55-4nonenonenoneC35H39O19763.676-1.2907
100-22-1highhighnoneC10H16N2164.2510.40939
1000058-38-7nonenonenoneC11H12N2O2204.228-4.6529
100-50-5nonenonehighC7H10O110.155-9.6048
100021-46-3nonenonenoneC9H11NO2165.191-3.1955
100-29-8nonenonenoneC8H9NO3167.163-8.928
100019-64-5nonenonenoneC9H10N2O7FP308.157-34.083
100-27-6lownonenoneC8H9NO3167.163-9.2735
1000-05-1nonenonehighC8H26O3Si4282.635-83.299
100007-67-8highnonelowC5H7OClF2156.559-12.702
1000339-22-9nonenonenoneC8H5NO4F2217.127-8.0943
10003-73-3nonenonenoneHCl.C7H10N2122.17-2.0712
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
1000018-40-5lowhighnoneC11H16N2O2S240.3261.4856
100018-96-0highhighnoneC20H39O2I438.428-31.232
100-90-3nonenonenoneC14H16N4O3S320.3724.7301
100031-92-3nonenonehighC10H30OSi4278.691-53.619
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
10001-30-6nonenonenoneC17H14O4282.294-0.8408
100-99-2nonenonelowC12H27Al198.328-22.009
100005-68-3nonenonenoneC13H12O4232.234-4.9451
10000-51-8nonenonenoneC14H15NO3245.2770.10503
1000018-49-4nonenonenoneC14H19NO5S313.3732.5797
1000269-68-0nonenonenoneC14H24N4248.3730.99367
10002-97-8nonenonenoneC18H30O2278.4340.24997
100010-99-9nonenonenoneC11H24O2188.31-23.185
100007-40-7nonenonenoneC31H42N4O7582.695-0.42167
100-41-4highhighhighC8H10106.167-2.68
1000018-13-2nonenonenoneC11H14NO2Br272.141-5.4951
1000-46-0nonenonenoneC7H18Ge174.83-4.6976
100-11-8lowhighnoneC7H6NO2Br216.034-13.162
100016-58-8nonehighnoneC19H19NO5341.3621.8385
100-49-2nonenonenoneC7H14O114.187-9.3679
10-13-2009nonenonenoneC15H14O5274.271-1.4702
100033-59-8nonenonenoneC8H16N2140.2290.9406
1000269-66-8nonenonenoneC12H20N4220.3190.5423
100-05-0nonenonenoneCl.C6H4N3O2150.117-9.1371
1000-63-1nonenonehighC8H18O130.23-19.78
100009-88-9nonenonenoneC18H45N7359.604-4.1108
100-21-0highnonehighC8H6O4166.132-1.8442
1000-40-4highnonelowC10H24S2Sn327.143-7.0269
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
100020-95-9highnonelowC12H17OCl212.719-11.962
1000018-06-3nonenonenoneC8H8N3Br226.0770.34749
1000339-13-8lownonelowC7H10NO4ClS239.678-21.883
100-26-5nonenonenoneC7H5NO4167.12-1.5746
100-61-8highnonenoneC7H9N107.155-0.23765
100005-01-4nonenonehighC8H21BrSSi2285.397-52.815