CAS RN: 598-10-7
1,1-Cyclopropanedicarboxylic Acid
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock3 grade groups
- Product code: SSC-168349
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: 1g, 5g, 10g, 25g, 100g, 500g
- Available purity: ≥95%
- Inventory rows with stock: 5
- 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 |
|---|---|---|---|---|
| 1g | ≥95% | 5 In Stock | Shenzhen | Inquiry |
| 5g | ≥95% | 5 In Stock | Hong Kong | Inquiry |
| 10g | ≥95% | 5 In Stock | Shanghai | Inquiry |
| 25g | ≥95% | 5 In Stock | Shanghai | Inquiry |
| 100g | ≥95% | 2 In Stock | Beijing | Inquiry |
| 500g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
598-10-7 / 2-methylidenebutanedioic acid
Basic Information
CAS
598-10-7
Multi CAS
Yes
Molecular Formula
C5H6O4
Molecular Weight
130.100000
Exact Mass
130.026609
InChI
InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)
InChIKey
LVHBHZANLOWSRM-UHFFFAOYSA-N
Physical Properties
Melting Point
162-164 °C WITH DECOMP, ALSO REPORTED AS 172 °C
175 °C
Boiling Point
268 °C, SUBLIMES
Density
1.632
Physical Description
Pellets or Large Crystals; Other Solid; Dry Powder
Hygroscopic solid; [Merck Index] White crystalline powder;
Solid
Appearance
RHOMBIC CRYSTALS FROM BENZENE
WHITE CRYSTALS
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.2
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
29.03
TPSA
74.6
LogP / Solubility
WLOGP
0.1
MLOGP
0.08
XLogP3
-0.1
Consensus LogP
0.03
Log S (ESOL)
-0.51
Class (ESOL)
Very soluble
Log S (Ali)
-0.7
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.95
Class (SILICOS-IT)
Very 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)
-3.44
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
