CAS RN: 4362-36-1
2-(2-chloroethyl)-1,3-dioxolane
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260628 |
5g |
Out of stock |
8-10 business days | Inquiry |
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Product code:
starshine_CAS4362-36-1
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Purity/Analytical Methods:
>99.0%
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4362-36-1 / 2-(2-chloroethyl)-1,3-dioxolane
Standard CAS: 4362-36-1
Multi CAS: No
Basic Information
CAS
4362-36-1
Multi CAS
No
Molecular Formula
C5H9CLO2
Molecular Weight
136.580000
Exact Mass
136.029107
InChI
InChI=1S/C5H9ClO2/c6-2-1-5-7-3-4-8-5/h5H,1-4H2
InChIKey
GBKZPLIJKMRYTE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
31.03
TPSA
18.46
LogP / Solubility
WLOGP
0.99
MLOGP
0.86
XLogP3
0.8
Consensus LogP
0.88
Log S (ESOL)
-1.18
Class (ESOL)
Soluble
Log S (Ali)
-1.39
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.61
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)
-2.85
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