Tetraammonium dipotassium vanadate

CAS Number: 61036-24-6

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[O-][V](=O)=O.[O-][V](=O)=O.O[V](=O)=O.O[V](=O)=O.O[V](=O)=O.O[V](=O)=O.N.N.N.N.[K+].[K+]

Molecule Information

Mutagenic: high Tumorigenic: none Irritant: high

Formula

HO3V.HO3V.HO3V.HO3V.O3V.O3V.K.K.H3N.H3N.H3N.H3N

Molecular Weight

99.9469

Drug-likeness

-2.5375

CAS

61036-24-6

InChI key

YZOYQAOOWIYXFD-UHFFFAOYSA-J

SMILES

[O-][V](=O)=O.[O-][V](=O)=O.O[V](=O)=O.O[V](=O)=O.O[V](=O)=O.O[V](=O)=O.N.N.N.N.[K+].[K+]

ChemrytIQ

CAS Information Snapshot

1 database item

Mutagenic

high

Tumorigenic

none

Handling Watch

Irritant: high | Reproductive effective: low

Molecule Information
Related CAS

Property	Value
CAS Number	61036-24-6
Molecule Name	Tetraammonium dipotassium vanadate
Molecular Formula	HO3V.HO3V.HO3V.HO3V.O3V.O3V.K.K.H3N.H3N.H3N.H3N
SMILES	[O-][V](=O)=O.[O-][V](=O)=O.O[V](=O)=O.O[V](=O)=O.O[V](=O)=O.O[V](=O)=O.N.N.N.N.[K+].[K+]
InChI	InChI=1S/2K.4H3N.4H2O.14O.6V/h;;41H3;41H2;;;;;;;;;;;;;;;;;;;;/q2+1;;;;;;;;;;;;;;;;;;;;;2-1;;;4*+1/p-4
InChI Key	YZOYQAOOWIYXFD-UHFFFAOYSA-J
CanonicalSyTyLFy	bf58c8033aa5bed6
TotalMolweight	743.985
Molecular Weight	99.9469
MonoisotopicMass	99.936532
CLogP	0.6634
CLogS	0.74
H Acceptors	3
H Donors	1
TotalSurfaceArea	39.18
Relative PSA	1
PolarSurfaceArea	54.37
Drug-likeness	-2.5375
Mutagenic	high
Tumorigenic	none
Reproductive Effective	low
Irritant	high
Nasty Functions	unwanted atom
Shape Index	0.75
Fragments	12
Non HAtoms	4
NonCHAtoms	4
Metal Atoms	1
Electronegative Atoms	3
Sp3Atoms	1
Symmetricatoms	1

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CAS Number	Mutagenic	Tumorigenic	Irritant	Molecule Formula	Mol Weight	Druglikeness	ChemrytIQ
1000058-38-7	none	none	none	C11H12N2O2	204.228	-4.6529	ChemrytIQ
1000-84-6	none	none	high	C4H9NO	87.1215	-6.3779	ChemrytIQ
100-52-7	high	high	high	C7H6O	106.124	-4.225	ChemrytIQ
1000017-98-0	none	none	none	C8H4N2O2BrCl	275.489	-2.5326	ChemrytIQ
10002-30-9	none	none	none	C12H9NOS	215.275	0.083087	ChemrytIQ
100007-67-8	high	none	low	C5H7OClF2	156.559	-12.702	ChemrytIQ
1000-70-0	none	low	high	C7H18N2Si2	186.406	-43.673	ChemrytIQ
1000068-23-4	none	low	none	C14H18NO5B	291.11	-44.603	ChemrytIQ
10003-95-9	none	none	none	C10H18N2O17P4	562.146	-25.989	ChemrytIQ
100021-79-2	none	high	high	C16H32O2.C2H8N2	256.428	-25.216	ChemrytIQ
100021-84-9	high	high	high	H3O4P.C18H36O2.C2H8N2	284.482	-25.216	ChemrytIQ
1000018-70-1	none	none	none	C15H18N2O6	322.316	-6.5762	ChemrytIQ
100004-94-2	none	none	none	C13H11NO2	213.235	-1.5864	ChemrytIQ
1000018-13-2	none	none	none	C11H14NO2Br	272.141	-5.4951	ChemrytIQ
100-44-7	high	high	none	C7H7Cl	126.586	-2.365	ChemrytIQ
1000018-21-2	none	none	none	C17H25N3O6S	399.467	-41.344	ChemrytIQ
100-89-0	none	none	low	C18H36O6B2	370.1	-16.157	ChemrytIQ
1000018-44-9	none	none	none	C13H16N2O5	280.279	-2.3885	ChemrytIQ
100009-88-9	none	none	none	C18H45N7	359.604	-4.1108	ChemrytIQ
100-91-4	none	none	high	C17H25NO3	291.39	3.3475	ChemrytIQ
1000339-26-3	none	none	none	C14H7N2OBrCl2	370.033	-0.59356	ChemrytIQ
100031-92-3	none	none	high	C10H30OSi4	278.691	-53.619	ChemrytIQ
100007-54-3	none	none	none	C28H30O13	574.533	-1.9839	ChemrytIQ
100008-36-4	none	none	none	C17H22O2	258.36	-5.6379	ChemrytIQ
100008-89-7	none	none	none	C11H10N4O3	246.225	-1.8465	ChemrytIQ
100020-94-8	high	none	low	C12H17OCl	212.719	-11.962	ChemrytIQ
100-51-6	high	high	high	C7H8O	108.14	-2.2456	ChemrytIQ
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100-41-4	high	high	high	C8H10	106.167	-2.68	ChemrytIQ
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100-74-3	high	none	high	C6H13NO	115.175	3.7593	ChemrytIQ
100023-32-3	high	high	none	CH3O4S.C20H19N2O	303.384	0.7545	ChemrytIQ
1000018-22-3	none	none	none	C16H22N3O4Br	400.272	-33.051	ChemrytIQ
1000-36-8	none	none	none	C11H25O3P	236.29	-27.011	ChemrytIQ
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1000198-76-4	none	none	none	C11H12NF3	215.217	-5.8988	ChemrytIQ
100001-06-7	none	none	none	I.C20H28NO	298.448	-2.3411	ChemrytIQ
10003-67-5	none	none	none	C33H62O6	554.849	-22.973	ChemrytIQ
1000-05-1	none	none	high	C8H26O3Si4	282.635	-83.299	ChemrytIQ
100-05-0	none	none	none	Cl.C6H4N3O2	150.117	-9.1371	ChemrytIQ
1000339-25-2	none	none	none	C14H8N2OBrF	319.133	-1.9975	ChemrytIQ
100012-67-7	high	high	high	C12H12O5	236.222	-19.846	ChemrytIQ
10003-94-8	none	none	none	C9H16N2O18P4	564.118	-31.509	ChemrytIQ
1000068-26-7	none	none	none	C13H15NO4BF	279.074	-46.077	ChemrytIQ
1000018-59-6	none	none	low	C10H15O2BrS	279.197	-14.078	ChemrytIQ
1000339-28-5	none	none	none	C14H8N2OBrCl	335.588	-0.59356	ChemrytIQ
1000-83-5	low	high	high	C2H6N2OS	106.149	-2.264	ChemrytIQ
1000068-24-5	none	none	low	C13H15NO4BCl	295.529	-44.638	ChemrytIQ
10001-82-8	none	none	none	C24H26N4O5S	482.559	9.4242	ChemrytIQ
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1000018-06-3	none	none	none	C8H8N3Br	226.077	0.34749	ChemrytIQ
100-15-2	none	high	none	C7H8N2O2	152.153	-5.7806	ChemrytIQ
10000-20-1	none	low	high	C12H32N2Si2	260.572	-64.51	ChemrytIQ
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