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, 0.25g, 25g, 100g
- Available purity: ≥97%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Request Bulk Quote
Recorded sizes, purity and stock details for CAS 13480-36-9
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 1g |
≥97% |
5
In Stock
|
Hong Kong |
Inquiry |
| 5g |
≥97% |
5
In Stock
|
Shenzhen |
Inquiry |
| 0.25g |
≥97% |
2
In Stock
|
Beijing |
Inquiry |
| 25g |
≥97% |
1
In Stock
|
Shanghai |
Inquiry |
| 100g |
≥97% |
0
Out of Stock
|
Shenzhen |
Inquiry |
13480-36-9 / 4-methylmorpholine-2,6-dione
Standard CAS: 13480-36-9
Multi CAS: No
Basic Information
CAS
13480-36-9
Multi CAS
No
Molecular Formula
C5H7NO3
Molecular Weight
129.110000
Exact Mass
129.042593
SMILES
CN1CC(=O)OC(=O)C1
InChI
InChI=1S/C5H7NO3/c1-6-2-4(7)9-5(8)3-6/h2-3H2,1H3
InChIKey
FGQJBZHMORPBRR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.6
H-bond acceptors
4
Molar refractivity
28.6
TPSA
46.61
LogP / Solubility
WLOGP
-1
MLOGP
-0.89
XLogP3
-0.2
Consensus LogP
-0.7
Log S (ESOL)
-0.01
Class (ESOL)
Very soluble
Log S (Ali)
0.1
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.33
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
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)
-4.22
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
Safety & Transport
Pictogram(s)
Corrosive
Irritant
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501