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CAS 56578-35-9 2-PROPENAL, 3-(4-METHYLPHENYL)-,(2E) molecular structure lightbox
CAS RN: 56578-35-9

2-PROPENAL, 3-(4-METHYLPHENYL)-,(2E)

Product Availability

Choose a grade to view its available package options.

10 package records10 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251105 100g In stock Inquiry
Batchno.20260213 1g In stock Inquiry
Batchno.20250816 25g In stock Inquiry
Batchno.20250826 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260621 100g In stock Shanghai Inquiry
Batchno.20250801 10g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250123 1g In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20250911 25g In stock Shanghai, Shenzhen Inquiry
Batchno.20251215 500g In stock Shanghai Inquiry
Batchno.20250907 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-164588
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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: 10g
  • Available purity: ≥95%
  • 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 56578-35-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥95% 0 Out of Stock Beijing Inquiry

56578-35-9 / 3-(4-methylphenyl)prop-2-enal

Standard CAS: 56578-35-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
56578-35-9
Multi CAS
Yes
Molecular Formula
C10H10O
Molecular Weight
146.190000
Exact Mass
146.073165
InChI
InChI=1S/C10H10O/c1-9-4-6-10(7-5-9)3-2-8-11/h2-8H,1H3/b3-2+
InChIKey
DKOUYOVAEBQFHU-NSCUHMNNSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.1
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
46.28
TPSA
17.07

LogP / Solubility

WLOGP
2.21
MLOGP
1.94
XLogP3
2.3
Consensus LogP
2.15
Log S (ESOL)
-2.41
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.35
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.68
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)
-2.04

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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