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CAS 13476-05-6 ERBIUM NITRATE HEXAHYDRATE molecular structure lightbox
CAS RN: 13476-05-6

ERBIUM NITRATE HEXAHYDRATE

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250205 25g / 100g / 500g / 2.5kg Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260322 25g / 100g / 500g / 2.5kg Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei Inquiry
  • Product code: starshine_CAS13476-05-6
  • Purity/Analytical Methods: >99.0%
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13476-05-6 / erbium(3+);trinitrate;hexahydrate

Standard CAS: 13476-05-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
13476-05-6
Multi CAS
No
Molecular Formula
ErH12N3O15
Molecular Weight
461.370000
Exact Mass
459.957143
SMILES
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Er+3]
InChI
InChI=1S/Er.3NO3.6H2O/c;3*2-1(3)4;;;;;;/h;;;;6*1H2/q+3;3*-1;;;;;;
InChIKey
SXJVNCWLEGIRSJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
H-bond acceptors
9
H-bond donors
6
Molar refractivity
52.77
TPSA
387.6

LogP / Solubility

WLOGP
-5.67
MLOGP
-4.95
XLogP3
-5.67
Consensus LogP
-5.43
Log S (ESOL)
0.87
Class (ESOL)
Highly soluble
Log S (Ali)
0.75
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.04
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-9.56

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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