CAS RN: 79827-25-1

2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATO SILVER (I)

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250706 5g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS79827-25-1
  • Purity/Analytical Methods: >99.0%
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79827-25-1 / silver (Z)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate

Standard CAS: 79827-25-1 Multi CAS: Yes

Basic Information

CAS
79827-25-1
Multi CAS
Yes
Molecular Formula
AgC11H19O2
Molecular Weight
291.140000
Exact Mass
290.043600
InChI
InChI=1S/C11H20O2.Ag/c1-10(2,3)8(12)7-9(13)11(4,5)6;/h7,12H,1-6H3;/q;+1/p-1/b8-7-;
InChIKey
DMTPLLMKZXCBKA-CFYXSCKTSA-M

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.73
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
52
TPSA
40.13

LogP / Solubility

WLOGP
1.89
MLOGP
1.67
XLogP3
1.89
Consensus LogP
1.82
Log S (ESOL)
-2.77
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.31
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.24
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)
-3.15

Drug-likeness / Medicinal Chemistry

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

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