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CAS 203186-56-5 METHYL 2-ACETYL-3-(DIMETHYLAMINO)ACRYLATE molecular structure lightbox
CAS RN: 203186-56-5

METHYL 2-ACETYL-3-(DIMETHYLAMINO)ACRYLATE

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250828 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: SSC-095678
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 203186-56-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

203186-56-5 / methyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate

Standard CAS: 203186-56-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
203186-56-5
Multi CAS
No
Molecular Formula
C8H13NO3
Molecular Weight
171.190000
Exact Mass
171.089543
SMILES
CC(=O)/C(=C\N(C)C)/C(=O)OC
InChI
InChI=1S/C8H13NO3/c1-6(10)7(5-9(2)3)8(11)12-4/h5H,1-4H3/b7-5+
InChIKey
RPFZLULJSPXVDO-FNORWQNLSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
44.47
TPSA
46.61

LogP / Solubility

WLOGP
0.19
MLOGP
0.17
XLogP3
0.4
Consensus LogP
0.25
Log S (ESOL)
-0.83
Class (ESOL)
Very soluble
Log S (Ali)
-1.1
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.29
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)
-3.63

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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