CAS RN: 68610-51-5
Poly(dicyclopentadiene-co-p-cresol)
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260405 | 5g / 25g / 100g / 500g / 2.5kg / 10kg | Confirm by inquiry | Shanghai, Shandong, Guangdong | 5-7 business days | Inquiry |
- Product code: starshine_CAS68610-51-5
- Purity/Analytical Methods: >99.0%
68610-51-5 / 4-methylphenol;2-methylprop-1-ene;tricyclo[5.2.1.02,6]deca-3,8-diene
Basic Information
CAS
68610-51-5
Multi CAS
Yes
Molecular Formula
C21H28O
Molecular Weight
296.400000
Exact Mass
296.214016
InChI
InChI=1S/C10H12.C7H8O.C4H8/c1-2-9-7-4-5-8(6-7)10(9)3-1;1-6-2-4-7(8)5-3-6;1-4(2)3/h1-2,4-5,7-10H,3,6H2;2-5,8H,1H3;1H2,2-3H3
InChIKey
UQQYHXZNSYZMEN-UHFFFAOYSA-N
Physical Properties
Physical Description
Pellets or Large Crystals; Dry Powder; Liquid; Other Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.43
H-bond acceptors
1
H-bond donors
1
Molar refractivity
94.81
TPSA
20.23
LogP / Solubility
WLOGP
5.67
MLOGP
5
XLogP3
5.67
Consensus LogP
5.45
Log S (ESOL)
-5.45
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.08
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.29
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.5
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
7
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