CAS RN: 87151-63-1
(+/-)-1-oxaspiro[4,5]dec-7-ene
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20251118 |
100mg / 250mg |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS87151-63-1
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Purity/Analytical Methods:
>99.0%
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87151-63-1 / 1-oxaspiro[4.5]dec-7-ene
Standard CAS: 87151-63-1
Multi CAS: No
Basic Information
CAS
87151-63-1
Multi CAS
No
Molecular Formula
C9H14O
Molecular Weight
138.210000
Exact Mass
138.104465
InChI
InChI=1S/C9H14O/c1-2-5-9(6-3-1)7-4-8-10-9/h1-2H,3-8H2
InChIKey
NJNWTZBTAYSXRE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.78
H-bond acceptors
1
Molar refractivity
40.91
TPSA
9.23
LogP / Solubility
WLOGP
2.28
MLOGP
2
XLogP3
2
Consensus LogP
2.09
Log S (ESOL)
-2.13
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.34
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.45
Class (SILICOS-IT)
Moderately 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)
-1.95
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
3