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CAS 27274-31-3 Allyloxypolyethyleneglycol molecular structure lightbox
CAS RN: 27274-31-3

Allyloxypolyethyleneglycol

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8 package records8 with current stock2 grade groups
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Batchno.20260426 100g In stock Inquiry
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  • Product code: starshine_CAS27274-31-3
  • Purity/Analytical Methods: >99.0%
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27274-31-3 / 2-prop-2-enoxyethanol

Standard CAS: 27274-31-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
27274-31-3
Multi CAS
Yes
Molecular Formula
C5H10O2
Molecular Weight
102.130000
Exact Mass
102.068080
InChI
InChI=1S/C5H10O2/c1-2-4-7-5-3-6/h2,6H,1,3-5H2
InChIKey
GCYHRYNSUGLLMA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.6
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
28.1
TPSA
29.46

LogP / Solubility

WLOGP
0.18
MLOGP
0.15
XLogP3
-0.1
Consensus LogP
0.08
Log S (ESOL)
-0.32
Class (ESOL)
Very soluble
Log S (Ali)
-0.53
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.95
Class (SILICOS-IT)
Very 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)
-3.21

Drug-likeness / Medicinal Chemistry

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

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