CAS RN: 931116-24-4
(R,E)-Deca-2-ene-4,6-diyne-1,8-diol
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.20250503 | 1mg | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS931116-24-4
- Purity/Analytical Methods: >99.0%
931116-24-4 / (E,8R)-dec-2-en-4,6-diyne-1,8-diol
Basic Information
CAS
931116-24-4
Multi CAS
Yes
Molecular Formula
C10H12O2
Molecular Weight
164.200000
Exact Mass
164.083730
InChI
InChI=1S/C10H12O2/c1-2-10(12)8-6-4-3-5-7-9-11/h5,7,10-12H,2,9H2,1H3/b7-5+/t10-/m1/s1
InChIKey
QFBMIOGKDCDLDH-BREXMAIKSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.4
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
48.08
TPSA
40.46
LogP / Solubility
WLOGP
0.31
MLOGP
0.27
XLogP3
0.9
Consensus LogP
0.49
Log S (ESOL)
-0.92
Class (ESOL)
Very soluble
Log S (Ali)
-1.13
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.23
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)
-3.5
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
2
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