CAS RN: 826-36-8

2,2,6,6-Tetramethyl-4-piperidone

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250705 100g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250417 10kg Out of stock Inquiry
Batchno.20250302 1kg In stock Shanghai Inquiry
Batchno.20251225 500g In stock Shanghai Inquiry
Batchno.20250713 5g In stock Shanghai, Tianjin Inquiry
  • Product code: ICTT1424
  • Purity/Analytical Methods: >98.0%(GC)(T)
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826-36-8 / 2,2,6,6-tetramethylpiperidin-4-one

Standard CAS: 826-36-8 Multi CAS: Yes

Basic Information

CAS
826-36-8
Multi CAS
Yes
Molecular Formula
C9H17NO
Molecular Weight
155.240000
Exact Mass
155.131014
InChI
InChI=1S/C9H17NO/c1-8(2)5-7(11)6-9(3,4)10-8/h10H,5-6H2,1-4H3
InChIKey
JWUXJYZVKZKLTJ-UHFFFAOYSA-N

Physical Properties

Melting Point
34.9 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.89
H-bond acceptors
2
H-bond donors
1
Molar refractivity
45.53
TPSA
29.1

LogP / Solubility

WLOGP
1.5
MLOGP
1.31
XLogP3
0.5
Consensus LogP
1.1
Log S (ESOL)
-1.75
Class (ESOL)
Soluble
Log S (Ali)
-1.91
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.91
Class (SILICOS-IT)
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)
-2.6

Drug-likeness / Medicinal Chemistry

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

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