CAS RN: 145526-76-7

m-PEG4-(CH2)3-alcohol

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250925 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS145526-76-7
  • Purity/Analytical Methods: >99.0%
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145526-76-7 / 3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]propan-1-ol

Standard CAS: 145526-76-7 Multi CAS: No

Basic Information

CAS
145526-76-7
Multi CAS
No
Molecular Formula
C10H22O5
Molecular Weight
222.280000
Exact Mass
222.146724
SMILES
COCCOCCOCCOCCCO
InChI
InChI=1S/C10H22O5/c1-12-5-6-14-9-10-15-8-7-13-4-2-3-11/h11H,2-10H2,1H3
InChIKey
FGSXSTKNKZJEAY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
12
H-bond acceptors
5
H-bond donors
1
Molar refractivity
56.04
TPSA
57.15

LogP / Solubility

WLOGP
0.07
MLOGP
0.06
XLogP3
-0.7
Consensus LogP
-0.19
Log S (ESOL)
-0.47
Class (ESOL)
Very soluble
Log S (Ali)
-1.43
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.6
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)
-4.03

Drug-likeness / Medicinal Chemistry

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

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