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CAS 12053-13-3 CHROMIUM SELENIDE molecular structure lightbox
CAS RN: 12053-13-3

CHROMIUM SELENIDE

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  • Product code: starshine_CAS12053-13-3
  • Purity/Analytical Methods: >99.0%
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12053-13-3 / selanylidenechromium

Chromium selenide (CrSe) | EINECS 234-999-1 | RefChem:125890

Standard CAS: 12053-13-3 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
12053-13-3
Multi CAS
Yes
Molecular Formula
CrSe
Molecular Weight
130.970000
Exact Mass
131.857030
SMILES
[Cr]=[Se]
InChI
InChI=1S/Cr.Se
InChIKey
UVZCKRKEVWSRGT-UHFFFAOYSA-N
Synonyms
Chromium selenide (CrSe) EINECS 234-999-1 RefChem:125890 DTXCID601436957 DTXSID001014274

Computed Properties

Structural Parameters

Heavy atom count
2
Molar refractivity
5.75
TPSA
0.0000

LogP / Solubility

WLOGP
-0.38
MLOGP
-0.35
XLogP3
-0.38
Consensus LogP
-0.37
Log S (ESOL)
-0.41
Class (ESOL)
Very soluble
Log S (Ali)
-0.36
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.19
Class (SILICOS-IT)
Very 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)
-3.79

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Acute Toxic Health Hazard Environmental Hazard
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation] H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure] H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P260, P261, P264, P270, P271, P273, P301+P316, P304+P340, P316, P319, P321, P330, P391, P403+P233, P405, and P501

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