CAS RN: 14040-11-0

Tungsten hexacarbonyl

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7 package records7 with current stock3 grade groups
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Batchno.20250626 25g In stock Shanghai, Shenzhen Inquiry
Batchno.20250209 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
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  • Product code: starshine_CAS14040-11-0
  • Purity/Analytical Methods: >99.0%
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14040-11-0 / carbon monoxide;tungsten

Standard CAS: 14040-11-0 Multi CAS: No

Basic Information

CAS
14040-11-0
Multi CAS
No
Molecular Formula
C6O6W
Molecular Weight
351.900000
Exact Mass
351.920421
SMILES
[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[W]
InChI
InChI=1S/6CO.W/c6*1-2;
InChIKey
FQNHWXHRAUXLFU-UHFFFAOYSA-N

Physical Properties

Physical Description
White solid; Insoluble in water; [Hawley]
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
13
H-bond acceptors
6
Molar refractivity
23.58
TPSA
119.4

LogP / Solubility

WLOGP
-0.23
MLOGP
-0.18
XLogP3
-0.23
Consensus LogP
-0.21
Log S (ESOL)
-1.88
Class (ESOL)
Soluble
Log S (Ali)
-2.28
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.76
Class (SILICOS-IT)
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)
-5.03

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Acute Toxic
Signal
Danger
GHS Hazard Statements
H301 (92.5%): Toxic if swallowed [Danger Acute toxicity, oral] H311 (81.1%): Toxic in contact with skin [Danger Acute toxicity, dermal] H331 (94.3%): Toxic if inhaled [Danger Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P321, P330, P361+P364, P403+P233, P405, and P501

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