CAS RN: 12207-64-6

diammonium tridecaoxotetramolybdate(2-)

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6 package records6 with current stock2 grade groups
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Batchno.20250710 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
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Batchno.20260322 500g In stock Shandong, Guangdong Inquiry
  • Product code: starshine_CAS12207-64-6
  • Purity/Analytical Methods: >99.0%
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12207-64-6 / diazanium;oxido-[[(oxido(dioxo)molybdenio)oxy-dioxomolybdenio]oxy-dioxomolybdenio]oxy-dioxomolybdenum

Standard CAS: 12207-64-6 Multi CAS: No

Basic Information

CAS
12207-64-6
Multi CAS
No
Molecular Formula
H8Mo4N2O13
Molecular Weight
627.900000
Exact Mass
624.625361
SMILES
[NH4+].[NH4+].[O-][Mo](=O)(=O)O[Mo](=O)(=O)O[Mo](=O)(=O)O[Mo](=O)(=O)[O-]
InChI
InChI=1S/4Mo.2H3N.13O/h;;;;2*1H3;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;2*-1/p+2
InChIKey
GNJLAZFSJKMTFK-UHFFFAOYSA-P

Computed Properties

Structural Parameters

Heavy atom count
19
Rotatable bonds
6
H-bond acceptors
13
H-bond donors
2
Molar refractivity
20.72
TPSA
283.37

LogP / Solubility

WLOGP
-2.79
MLOGP
-2.4
XLogP3
-2.79
Consensus LogP
-2.66
Log S (ESOL)
-1.58
Class (ESOL)
Soluble
Log S (Ali)
-2.69
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.14
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
Low
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)
-8.53

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (28.6%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (28.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (28.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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