Lutetium nitrate--water (1/3/1)

CAS Number: 100641-16-5

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[O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.O.[Lu+3]

Molecule Information

Mutagenic: none Tumorigenic: none Irritant: none

Formula

Lu.NO3.NO3.NO3.H2O

Molecular Weight

62.004

Drug-likeness

-9.919

CAS

100641-16-5

InChI key

XZBUOUZGWUJJES-UHFFFAOYSA-N

SMILES

[O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.O.[Lu+3]

ChemrytIQ

CAS Information Snapshot

1 database item

Mutagenic

none

Tumorigenic

none

Handling Watch

Irritant: none | Reproductive effective: none

Molecule Information
Related CAS

Property	Value
CAS Number	100641-16-5
Molecule Name	Lutetium nitrate--water (1/3/1)
Molecular Formula	Lu.NO3.NO3.NO3.H2O
SMILES	[O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.O.[Lu+3]
InChI	InChI=1S/Lu.3NO3.H2O/c;32-1(3)4;/h;;;;1H2/q+3;3-1;
InChI Key	XZBUOUZGWUJJES-UHFFFAOYSA-N
CanonicalSyTyLFy	4110c2bbf072238b
TotalMolweight	378.997
Molecular Weight	62.004
MonoisotopicMass	61.987819
CLogP	-0.8585
CLogS	-1.108
H Acceptors	4
TotalSurfaceArea	43.46
Relative PSA	1
PolarSurfaceArea	62.89
Drug-likeness	-9.919
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.75
Fragments	5
Non HAtoms	4
NonCHAtoms	4
Electronegative Atoms	4
Sp3Atoms	2
Symmetricatoms	1
AcidicOxygens	2

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CAS Number	Mutagenic	Tumorigenic	Irritant	Molecule Formula	Mol Weight	Druglikeness	ChemrytIQ
100005-44-5	high	none	low	C7H5O2ClS	188.634	-11.771	ChemrytIQ
1000018-71-2	none	none	high	C14H19N3O4	293.322	-2.5213	ChemrytIQ
100008-89-7	none	none	none	C11H10N4O3	246.225	-1.8465	ChemrytIQ
100-41-4	high	high	high	C8H10	106.167	-2.68	ChemrytIQ
100-07-2	high	high	low	C8H7O2Cl	170.595	-10.49	ChemrytIQ
1000198-80-0	none	none	none	C11H14NF	179.237	-0.04876	ChemrytIQ
10000-42-7	high	high	low	C20H18N4O3	362.388	-5.7793	ChemrytIQ
100004-79-3	none	none	none	C13H11NO2	213.235	-1.5864	ChemrytIQ
100004-78-2	none	none	none	C16H11NO2	249.268	-1.5746	ChemrytIQ
100-13-0	none	none	low	C8H7NO2	149.149	-10.212	ChemrytIQ
10001-08-8	none	none	high	C11H22N2O	198.309	-3.1037	ChemrytIQ
100-77-6	none	none	none	C6H4N2Cl.Cl	139.565	-4.1248	ChemrytIQ
1000-16-4	none	none	none	C13H30NO3P	279.359	-34.244	ChemrytIQ
100004-54-4	none	high	none	C4H8Te	183.708	-3.9699	ChemrytIQ
1000025-93-3	none	none	none	C20H17NO4	335.358	-1.6731	ChemrytIQ
1000269-67-9	none	none	none	C13H22N4	234.346	0.99367	ChemrytIQ
1000339-51-4	none	none	none	C7H4NO4F	185.11	-8.2861	ChemrytIQ
1000339-54-7	none	none	none	C9H7O2F3	204.147	-11.176	ChemrytIQ
10002-06-9	none	none	none	C10H8N3ClS	237.714	2.0874	ChemrytIQ
1000018-25-6	none	none	none	C13H24N2O6S	336.408	-32.405	ChemrytIQ
100004-80-6	none	none	none	C13H11NO3	229.234	-1.3547	ChemrytIQ
017257-81-7	none	none	none	C6H10O2	114.143	0.9106	ChemrytIQ
100007-57-6	none	none	none	C72H113N19O24S6	1821.19	-13.821	ChemrytIQ
100021-82-7	none	none	none	H3O4P.C18H38N2O	298.513	-22.282	ChemrytIQ
10001-46-4	none	none	none	C9H11N3O3	209.204	1.9565	ChemrytIQ
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100-64-1	high	high	none	C6H11NO	113.159	-6.4182	ChemrytIQ
100010-00-2	none	none	none	C20H23NO5	357.405	-3.7157	ChemrytIQ
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100-62-9	low	none	none	C7H7N	105.14	-1.1924	ChemrytIQ
100-87-8	none	none	none	C7H8O3S	172.204	-10.732	ChemrytIQ
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100016-58-8	none	high	none	C19H19NO5	341.362	1.8385	ChemrytIQ
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1000-40-4	high	none	low	C10H24S2Sn	327.143	-7.0269	ChemrytIQ
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100-44-7	high	high	none	C7H7Cl	126.586	-2.365	ChemrytIQ
100-15-2	none	high	none	C7H8N2O2	152.153	-5.7806	ChemrytIQ
100-17-4	none	none	none	C7H7NO3	153.137	-7.2945	ChemrytIQ
1000018-24-5	none	none	none	C12H18N4O3	266.3	-0.33651	ChemrytIQ
1000017-94-6	none	none	none	C8H5N2O2Cl	196.593	2.9136	ChemrytIQ
100004-93-1	none	high	none	C16H11NO2	249.268	-1.5746	ChemrytIQ
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1000-67-5	none	none	high	C4H9O4S.Na	153.177	-10.412	ChemrytIQ
1000018-50-7	none	none	none	C13H16N2O4	264.28	-7.3568	ChemrytIQ
100-99-2	none	none	low	C12H27Al	198.328	-22.009	ChemrytIQ
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