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CAS 13419-69-7 trans-2-Hexenoic Acid molecular structure lightbox
CAS RN: 13419-69-7

trans-2-Hexenoic Acid

Product Availability

Choose a grade to view its available package options.

9 package records9 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251030 100g In stock Inquiry
Batchno.20260429 25g In stock Inquiry
Batchno.20260114 500g In stock Inquiry
Batchno.20250110 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260403 100g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20260616 1kg In stock Tianjin, Wuhan Inquiry
Batchno.20260622 25g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250528 500g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251118 5g / 25g / 100g / 500g / 1kg Confirm by inquiry Shanghai, Shandong, Chongqing Inquiry
  • Product code: SSC-041597
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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 13419-69-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ≥97% 0 Out of Stock Shanghai Inquiry

13419-69-7 / (E)-hex-2-enoic acid

Standard CAS: 13419-69-7 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
13419-69-7
Multi CAS
No
Molecular Formula
C6H10O2
Molecular Weight
114.140000
Exact Mass
114.068080
SMILES
CCC/C=C/C(=O)O
InChI
InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
InChIKey
NIONDZDPPYHYKY-SNAWJCMRSA-N

Physical Properties

Melting Point
28.00 to 34.00 °C. @ 760.00 mm Hg
Boiling Point
217.00 °C. @ 760.00 mm Hg
Physical Description
Solid Colourless needle-like crystals; Fatty acrid musty aroma/sweet on dilution
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
31.68
TPSA
37.3

LogP / Solubility

WLOGP
1.43
MLOGP
1.25
XLogP3
1.6
Consensus LogP
1.43
Log S (ESOL)
-1.25
Class (ESOL)
Soluble
Log S (Ali)
-1.53
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.95
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)
-2.4

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

Safety & Transport

Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

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