CAS RN: 12039-19-9

YTTRIUM SULFIDE

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Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250104 100mg / 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
  • Product code: starshine_CAS12039-19-9
  • Purity/Analytical Methods: >99.0%
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12039-19-9 / bis(yttrium(3+));trisulfide

Yttrium sulfide (Y2S3) | EINECS 234-887-2 | RefChem:195764

Standard CAS: 12039-19-9 Multi CAS: Yes

Basic Information

CAS
12039-19-9
Multi CAS
Yes
Molecular Formula
S3Y2
Molecular Weight
274.000000
Exact Mass
273.727890
SMILES
[S-2].[S-2].[S-2].[Y+3].[Y+3]
InChI
InChI=1S/3S.2Y/q3*-2;2*+3
InChIKey
BPMRLDMEAPSVQN-UHFFFAOYSA-N
Synonyms
Yttrium sulfide (Y2S3) EINECS 234-887-2 RefChem:195764 Yttrium sulfide Diyttrium trisulphide

Physical Properties

Physical Description
Yellow powder with an odor of rotten eggs
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
5
H-bond acceptors
3
Molar refractivity
22.09
TPSA
3.0000

LogP / Solubility

WLOGP
-0.01
XLogP3
-0.01
Consensus LogP
-0.01
Log S (ESOL)
-1.53
Class (ESOL)
Soluble
Log S (Ali)
-1.8
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.43
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)
-4.4

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)
Flammable Irritant
Signal
Danger
GHS Hazard Statements
H261 (100%): In contact with water releases flammable gas [Danger Substances and mixtures which in contact with water, emit flammable gases] 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
P231+P232, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P402+P404, P403+P233, P405, and P501

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