CAS RN: 135682-18-7
(S)-(-)-4-(Methoxymethyl)-1,3-dioxolan-2-one
Product Availability
Choose a grade to view its available package options.
2 package records2 with current stock1 grade group
- Product code: SSC-044225
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: 5g
- Available purity: 0
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | 0 | 0 Out of Stock | Hong Kong | Inquiry |
135682-18-7 / (4S)-4-(methoxymethyl)-1,3-dioxolan-2-one
Basic Information
CAS
135682-18-7
Multi CAS
No
Molecular Formula
C5H8O4
Molecular Weight
132.110000
Exact Mass
132.042259
SMILES
COC[C@H]1COC(=O)O1
InChI
InChI=1S/C5H8O4/c1-7-2-4-3-8-5(6)9-4/h4H,2-3H2,1H3/t4-/m0/s1
InChIKey
DNSGQMOSYDHNHO-BYPYZUCNSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.8
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
28.1
TPSA
44.76
LogP / Solubility
WLOGP
0.17
MLOGP
0.14
XLogP3
-0.9
Consensus LogP
-0.2
Log S (ESOL)
-0.63
Class (ESOL)
Very soluble
Log S (Ali)
-0.76
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.9
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)
-3.41
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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(R)-(+)-4-(Methoxymethyl)-1,3-dioxolan-2-one
- CAS RN: 185836-34-4
- Product Code: SSC-086056
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