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CAS 35233-69-3 METHYL METHACRYLATE-D8 molecular structure lightbox
CAS RN: 35233-69-3

METHYL METHACRYLATE-D8

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260603 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS35233-69-3
  • Purity/Analytical Methods: >99.0%
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35233-69-3 / trideuteriomethyl 3,3-dideuterio-2-(trideuteriomethyl)prop-2-enoate

Standard CAS: 35233-69-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
35233-69-3
Multi CAS
Yes
Molecular Formula
C5H8O2
Molecular Weight
108.160000
Exact Mass
108.102643
InChI
InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3/i1D2,2D3,3D3
InChIKey
VVQNEPGJFQJSBK-MGGKGRBPSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
26.83
TPSA
26.3

LogP / Solubility

WLOGP
0.74
MLOGP
0.64
XLogP3
1.4
Consensus LogP
0.93
Log S (ESOL)
-0.86
Class (ESOL)
Very soluble
Log S (Ali)
-0.91
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.04
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)
-2.81

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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