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CAS 10138-52-0 Gadolinium(III) chloride molecular structure lightbox
CAS RN: 10138-52-0

Gadolinium(III) chloride

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  • Product code: starshine_CAS10138-52-0
  • Purity/Analytical Methods: >99.0%
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10138-52-0 / trichlorogadolinium

GADOLINIUM CHLORIDE | gadolinium(III) chloride | Gadolinium chloride (GdCl3)

Standard CAS: 10138-52-0 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
10138-52-0
Multi CAS
Yes
Molecular Formula
Cl3Gd
Molecular Weight
263.600000
Exact Mass
262.830670
SMILES
Cl[Gd](Cl)Cl
InChI
InChI=1S/3ClH.Gd/h3*1H;/q;;;+3/p-3
InChIKey
MEANOSLIBWSCIT-UHFFFAOYSA-K
Synonyms
GADOLINIUM CHLORIDE gadolinium(III) chloride Gadolinium chloride (GdCl3) CHEBI:37288 P7082WY76D

Physical Properties

Physical Description
White crystals; Soluble in water; [Merck Index]
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
4
Molar refractivity
17.56
TPSA
0.0000

LogP / Solubility

WLOGP
2.07
MLOGP
1.83
XLogP3
2.07
Consensus LogP
1.99
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.22
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.09
Class (SILICOS-IT)
Poorly 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)
-2.86

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (16.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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