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CAS 7443-25-6 Dimethyl 2-(4-Methoxybenzylidene)malonate molecular structure lightbox
CAS RN: 7443-25-6

Dimethyl 2-(4-Methoxybenzylidene)malonate

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250331 10g In stock Shanghai Inquiry
Batchno.20260505 1g In stock Shanghai Inquiry
Batchno.20250908 25g In stock Shanghai Inquiry
Batchno.20250604 5g In stock Shanghai Inquiry
  • Product code: SSC-183903
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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: 100g
  • 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 7443-25-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Shanghai Inquiry

7443-25-6 / dimethyl 2-[(4-methoxyphenyl)methylidene]propanedioate

Standard CAS: 7443-25-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7443-25-6
Multi CAS
Yes
Molecular Formula
C13H14O5
Molecular Weight
250.250000
Exact Mass
250.084124
InChI
InChI=1S/C13H14O5/c1-16-10-6-4-9(5-7-10)8-11(12(14)17-2)13(15)18-3/h4-8H,1-3H3
InChIKey
JMFYZMAVUHNCPW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.23
Rotatable bonds
4
H-bond acceptors
5
Molar refractivity
65
TPSA
61.83

LogP / Solubility

WLOGP
1.42
MLOGP
1.26
XLogP3
2.5
Consensus LogP
1.73
Log S (ESOL)
-2.27
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.64
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.95
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)
-3.24

Drug-likeness / Medicinal Chemistry

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

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