CAS RN: 3588-17-8
trans,trans-Muconic Acid
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-142951
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 10g, 5g, 25g, 100g, 0.25g, 1g
- Available purity: >98%
- Inventory rows with stock: 8
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 10g | -- | 3 In Stock | Shanghai | Inquiry |
| 10g | >98% | 3 In Stock | Beijing | Inquiry |
| 5g | -- | 2 In Stock | Shenzhen | Inquiry |
| 5g | >98% | 2 In Stock | Beijing | Inquiry |
| 25g | -- | 1 In Stock | Shenzhen | Inquiry |
| 25g | >98% | 1 In Stock | Shenzhen | Inquiry |
| 100g | -- | 1 In Stock | Shenzhen | Inquiry |
| 100g | >98% | 1 In Stock | Shanghai | Inquiry |
| 0.25g | -- | 0 Out of Stock | Shanghai | Inquiry |
| 0.25g | >98% | 0 Out of Stock | Shenzhen | Inquiry |
| 1g | -- | 0 Out of Stock | Shenzhen | Inquiry |
| 1g | >98% | 0 Out of Stock | Hong Kong | Inquiry |
3588-17-8 / hexa-2,4-dienedioic acid
Basic Information
CAS
3588-17-8
Multi CAS
Yes
Molecular Formula
C6H6O4
Molecular Weight
142.110000
Exact Mass
142.026609
InChI
InChI=1S/C6H6O4/c7-5(8)3-1-2-4-6(9)10/h1-4H,(H,7,8)(H,9,10)
InChIKey
TXXHDPDFNKHHGW-UHFFFAOYSA-N
Physical Properties
Physical Description
Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
10
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
33.55
TPSA
74.6
LogP / Solubility
WLOGP
0.27
MLOGP
0.23
XLogP3
0.2
Consensus LogP
0.23
Log S (ESOL)
-0.69
Class (ESOL)
Very soluble
Log S (Ali)
-0.92
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.17
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)
-3.4
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
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