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CAS 122413-85-8 4-Glycidyloxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical molecular structure lightbox
CAS RN: 122413-85-8

4-Glycidyloxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250401 1g In stock Shanghai, Shandong, Chongqing Inquiry
Batchno.20250305 200mg In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20250726 5g In stock Shandong Inquiry
  • Product code: ICTG0555
  • Purity/Analytical Methods: >95.0%(GC)(T)
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122413-85-8 / 4-Glycidyloxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical

Standard CAS: 122413-85-8 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
122413-85-8
Multi CAS
No
Molecular Formula
C12H22NO3
Molecular Weight
228.310000
Exact Mass
228.159969
SMILES
CC1(CC(CC(N1[O])(C)C)OCC2CO2)C
InChI
InChI=1S/C12H22NO3/c1-11(2)5-9(15-7-10-8-16-10)6-12(3,4)13(11)14/h9-10H,5-8H2,1-4H3
InChIKey
AYJPKWBJZNALTL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
59.4
TPSA
44.9

LogP / Solubility

WLOGP
1.77
MLOGP
1.56
XLogP3
1.1
Consensus LogP
1.48
Log S (ESOL)
-2.17
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.71
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.97
Class (SILICOS-IT)
Moderately 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)
-2.86

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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