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CAS 14951-50-9 DIMETHYL(ACETYLACETONATE)GOLD(III) molecular structure lightbox
CAS RN: 14951-50-9

DIMETHYL(ACETYLACETONATE)GOLD(III)

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7 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250214 100mg Out of stock Inquiry
Batchno.20250317 10mg Out of stock Inquiry
Batchno.20260507 250mg Out of stock Inquiry
Batchno.20250111 25mg In stock Shanghai Inquiry
Batchno.20251012 500mg Out of stock 8-10 business days Inquiry
Batchno.20250118 50mg In stock Shanghai Inquiry
Batchno.20250906 5mg Out of stock Inquiry
  • Product code: starshine_CAS14951-50-9
  • Purity/Analytical Methods: >99.0%
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14951-50-9 / carbanide;gold;(E)-4-hydroxypent-3-en-2-one

Standard CAS: 14951-50-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14951-50-9
Multi CAS
No
Molecular Formula
C7H14AuO2-2
Molecular Weight
327.150000
Exact Mass
327.065950
SMILES
[CH3-].[CH3-].C/C(=C\C(=O)C)/O.[Au]
InChI
InChI=1S/C5H8O2.2CH3.Au/c1-4(6)3-5(2)7;;;/h3,6H,1-2H3;2*1H3;/q;2*-1;/b4-3+;;;
InChIKey
OODGPXRGNOXCBP-FHJHGPAASA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.29
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
39.89
TPSA
37.3

LogP / Solubility

WLOGP
1.94
MLOGP
1.72
XLogP3
1.94
Consensus LogP
1.87
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.64
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.51
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)
-3.34

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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