CAS RN: 33691-73-5
5-HYDROXYPIPERIDIN-2-ONE
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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: 0.1g, 0.25g, 1g
- Available purity: >95%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 33691-73-5
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.1g |
>95% |
2
In Stock
|
Shenzhen |
Inquiry |
| 0.25g |
>95% |
2
In Stock
|
Beijing |
Inquiry |
| 1g |
>95% |
2
In Stock
|
Shanghai |
Inquiry |
33691-73-5 / 5-hydroxyoxan-2-one
Standard CAS: 33691-73-5
Multi CAS: No
Basic Information
CAS
33691-73-5
Multi CAS
No
Molecular Formula
C5H8O3
Molecular Weight
116.110000
Exact Mass
116.047344
InChI
InChI=1S/C5H8O3/c6-4-1-2-5(7)8-3-4/h4,6H,1-3H2
InChIKey
IHQMTBUROQWHDL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Fraction Csp3
0.8
H-bond acceptors
3
H-bond donors
1
Molar refractivity
26.2
TPSA
46.53
LogP / Solubility
WLOGP
-0.32
MLOGP
-0.29
XLogP3
-0.4
Consensus LogP
-0.34
Log S (ESOL)
-0.36
Class (ESOL)
Very soluble
Log S (Ali)
-0.28
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.15
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)
-3.65
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2