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CAS 20407-84-5 trans-2-Dodecenal molecular structure lightbox
CAS RN: 20407-84-5

trans-2-Dodecenal

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250623 100g Out of stock Inquiry
Batchno.20250126 1g In stock Shanghai, Chengdu Inquiry
Batchno.20250629 25g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250113 5g In stock Shanghai Inquiry
  • Product code: SSC-096017
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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: 25g
  • 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 20407-84-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Beijing Inquiry

20407-84-5 / (E)-dodec-2-enal

Standard CAS: 20407-84-5 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
20407-84-5
Multi CAS
No
Molecular Formula
C12H22O
Molecular Weight
182.300000
Exact Mass
182.167065
SMILES
CCCCCCCCC/C=C/C=O
InChI
InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h10-12H,2-9H2,1H3/b11-10+
InChIKey
SSNZFFBDIMUILS-ZHACJKMWSA-N

Physical Properties

Boiling Point
73.00 to 74.00 °C. @ 0.50 mm Hg
Density
0.839-0.849
Physical Description
Liquid Clear, colorless to pale yellow liquid with a fatty odor; Colourless to slightly yellow liquid; Fatty, citus-like aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.75
Rotatable bonds
9
H-bond acceptors
1
Molar refractivity
57.81
TPSA
17.07

LogP / Solubility

WLOGP
3.88
MLOGP
3.41
XLogP3
4.8
Consensus LogP
4.03
Log S (ESOL)
-2.82
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.86
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.15
Class (SILICOS-IT)
Slightly 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)
-1.08

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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