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CAS 12031-65-1 Lithium Nickel Oxide molecular structure lightbox
CAS RN: 12031-65-1

Lithium Nickel Oxide

  • Product code: SSC-021173
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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: ＞95%
  • 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 12031-65-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞95% 0 Out of Stock Shenzhen Inquiry

12031-65-1 / lithium oxido(oxo)nickel

Lithium nickel oxide (LiNiO2) | Lithium nickel oxide | Lithium nickelate

Standard CAS: 12031-65-1 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
12031-65-1
Multi CAS
Yes
Molecular Formula
LiNiO2
Molecular Weight
97.700000
Exact Mass
96.941174
SMILES
[Li+].[O-][Ni]=O
InChI
InChI=1S/Li.Ni.2O/q+1;;;-1
InChIKey
VROAXDSNYPAOBJ-UHFFFAOYSA-N
Synonyms
Lithium nickel oxide (LiNiO2) Lithium nickel oxide Lithium nickelate RefChem:799581 DTXCID001436880

Physical Properties

Physical Description
Dry Powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
4
H-bond acceptors
2
Molar refractivity
0.69
TPSA
40.13

LogP / Solubility

WLOGP
-4.31
MLOGP
-3.8
XLogP3
-4.31
Consensus LogP
-4.14
Log S (ESOL)
2.27
Class (ESOL)
Highly soluble
Log S (Ali)
2.75
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.28
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)
-6.37

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant Health Hazard
Signal
Danger
GHS Hazard Statements
H317: May cause an allergic skin reaction [Warning Sensitization, Skin] H350i: May cause cancer by inhalation [Danger Carcinogenicity] H372 **: Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure] H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin] H350 (99.4%): May cause cancer [Danger Carcinogenicity]
Precautionary Statement Codes
P203, P260, P261, P264, P270, P272, P280, P302+P352, P318, P319, P321, P333+P317, P362+P364, P405, and P501

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