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CAS 101509-27-7 NEODYMIUM SULFATE molecular structure lightbox
CAS RN: 101509-27-7

NEODYMIUM SULFATE

  • Product code: SSC-002345
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 101509-27-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Hong Kong Inquiry

101509-27-7 / bis(neodymium(3+));trisulfate;hydrate

DTXSID80692902 | Neodymium sulfate--water (2/3/1) | RefChem:365480

Standard CAS: 101509-27-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
101509-27-7
Multi CAS
Yes
Molecular Formula
H2Nd2O13S3
Molecular Weight
594.700000
Exact Mass
591.683580
SMILES
O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Nd+3].[Nd+3]
InChI
InChI=1S/2Nd.3H2O4S.H2O/c;;3*1-5(2,3)4;/h;;3*(H2,1,2,3,4);1H2/q2*+3;;;;/p-6
InChIKey
RHVPCSSKNPYQDU-UHFFFAOYSA-H
Synonyms
DTXSID80692902 Neodymium sulfate--water (2/3/1) RefChem:365480 DTXCID80643651 Neodymium(III) sulfate hydrate

Computed Properties

Structural Parameters

Heavy atom count
18
H-bond acceptors
12
H-bond donors
1
Molar refractivity
35.04
TPSA
272.28

LogP / Solubility

WLOGP
-4.84
MLOGP
-4.21
XLogP3
-4.84
Consensus LogP
-4.63
Log S (ESOL)
-0.48
Class (ESOL)
Very soluble
Log S (Ali)
-0.94
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.49
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)
-9.78

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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