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CAS 1314-06-3 Nickel oxide molecular structure lightbox
CAS RN: 1314-06-3

Nickel oxide

  • Product code: SSC-038243
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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: 100g
  • 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 1314-06-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Shanghai Inquiry

1314-06-3 / bis(nickel(3+));tris(oxygen(2-))

Standard CAS: 1314-06-3 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1314-06-3
Multi CAS
No
Molecular Formula
Ni2O3
Molecular Weight
165.385000
Exact Mass
163.855427
SMILES
[O-2].[O-2].[O-2].[Ni+3].[Ni+3]
InChI
InChI=1S/2Ni.3O/q2*+3;3*-2
InChIKey
GNMQOUGYKPVJRR-UHFFFAOYSA-N

Physical Properties

Physical Description
Dry Powder Gray-black solid, soluble in water; [Merck Index] Insoluble in water; [Hawley]
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
5
H-bond acceptors
3
Molar refractivity
2.06
TPSA
85.5

LogP / Solubility

WLOGP
-0.36
MLOGP
-0.32
XLogP3
-0.36
Consensus LogP
-0.35
Log S (ESOL)
-0.64
Class (ESOL)
Very soluble
Log S (Ali)
-0.66
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.44
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
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)
-3.99

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] H413: May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement Codes
P203, P260, P261, P264, P270, P272, P273, P280, P302+P352, P318, P319, P321, P333+P317, P362+P364, P405, and P501 P203, P233, P260, P261, P264, P270, P271, P272, P280, P284, P302+P352, P304+P340, P318, P319, P321, P333+P317, P342+P316, P362+P364, P403, P405, and P501

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