CAS RN: 31693-08-0

POLY(2-HYDROXYETHYL METHACRYLATE/METHACRYLIC ACID)

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251107 1g / 5g / 25g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS31693-08-0
  • Purity/Analytical Methods: >99.0%
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31693-08-0 / 2-hydroxyethyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid

Standard CAS: 31693-08-0 Multi CAS: Yes

Basic Information

CAS
31693-08-0
Multi CAS
Yes
Molecular Formula
C10H16O5
Molecular Weight
216.230000
Exact Mass
216.099774
InChI
InChI=1S/C6H10O3.C4H6O2/c1-5(2)6(8)9-4-3-7;1-3(2)4(5)6/h7H,1,3-4H2,2H3;1H2,2H3,(H,5,6)
InChIKey
NORSCOJMIBLOFM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.4
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
55.31
TPSA
83.83

LogP / Solubility

WLOGP
0.75
MLOGP
0.66
XLogP3
0.75
Consensus LogP
0.72
Log S (ESOL)
-1.39
Class (ESOL)
Soluble
Log S (Ali)
-1.87
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.16
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.51

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
1.5

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