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CAS 34269-03-9 INDIUM (2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATE) molecular structure lightbox
CAS RN: 34269-03-9

INDIUM (2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATE)

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260121 100mg In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250918 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai, Chongqing 5-7 business days Inquiry
Batchno.20250726 1g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251024 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250304 5g In stock Shenzhen, Tianjin, Chengdu Inquiry
  • Product code: starshine_CAS34269-03-9
  • Purity/Analytical Methods: >99.0%
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34269-03-9 / (E)-5-bis[[(E)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl]oxy]indiganyloxy-2,2,6,6-tetramethylhept-4-en-3-one

Standard CAS: 34269-03-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
34269-03-9
Multi CAS
Yes
Molecular Formula
C33H57InO6
Molecular Weight
664.600000
Exact Mass
664.319393
InChI
InChI=1S/3C11H20O2.In/c3*1-10(2,3)8(12)7-9(13)11(4,5)6;/h3*7,12H,1-6H3;/q;;;+3/p-3/b3*8-7+;
InChIKey
YVKGYGRXJLEUTO-QFVJJVGWSA-K

Computed Properties

Structural Parameters

Heavy atom count
40
Fraction Csp3
0.73
Rotatable bonds
9
H-bond acceptors
6
Molar refractivity
165.01
TPSA
78.9

LogP / Solubility

WLOGP
8.66
MLOGP
7.67
XLogP3
8.66
Consensus LogP
8.33
Log S (ESOL)
-8.82
Class (ESOL)
Insoluble
Log S (Ali)
-11.26
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.25
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.63

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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