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CAS 6728-26-3 trans-2-Hexenal molecular structure lightbox
CAS RN: 6728-26-3

trans-2-Hexenal

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260628 100ml In stock Inquiry
Batchno.20260421 25ml In stock Inquiry
Batchno.20250402 500ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260311 25ml / 100ml / 500ml / 2.5L Confirm by inquiry Shanghai, Shandong, Hebei Inquiry
  • Product code: SSC-176962
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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: 500g
  • 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 6728-26-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ＞97% 0 Out of Stock Shanghai Inquiry

6728-26-3 / hex-2-enal

Standard CAS: 6728-26-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6728-26-3
Multi CAS
Yes
Molecular Formula
C6H10O
Molecular Weight
98.140000
Exact Mass
98.073165
InChI
InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3
InChIKey
MBDOYVRWFFCFHM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
30.11
TPSA
17.07

LogP / Solubility

WLOGP
1.54
MLOGP
1.34
XLogP3
1.5
Consensus LogP
1.46
Log S (ESOL)
-1.22
Class (ESOL)
Soluble
Log S (Ali)
-1.48
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.94
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)
-2.22

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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