CAS RN: 12125-22-3

PALLADIUM(II) SULFIDE

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  • Product code: starshine_CAS12125-22-3
  • Purity/Analytical Methods: >99.0%
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12125-22-3 / sulfanylidenepalladium

Palladium sulphide | Palladium sulfide (PdS) | EINECS 235-190-6

Standard CAS: 12125-22-3 Multi CAS: Yes

Basic Information

CAS
12125-22-3
Multi CAS
Yes
Molecular Formula
PdS
Molecular Weight
138.490000
Exact Mass
137.875550
SMILES
S=[Pd]
InChI
InChI=1S/Pd.S
InChIKey
NRUVOKMCGYWODZ-UHFFFAOYSA-N
Synonyms
Palladium sulphide Palladium sulfide (PdS) EINECS 235-190-6 RefChem:169630 DTXSID00893217

Physical Properties

Physical Description
Dry Powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
2
H-bond acceptors
1
Molar refractivity
7.59
TPSA
32.1000

LogP / Solubility

WLOGP
0.65
MLOGP
0.56
XLogP3
0.65
Consensus LogP
0.62
Log S (ESOL)
-1.11
Class (ESOL)
Soluble
Log S (Ali)
-1.16
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.1
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.11

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
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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