![CAS 96184-40-6 4-[trans-4-[(E)-1-Propenyl]cyclohexyl]benzonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/p2378-jpgcontextbwfzdgvyfhjvb3r8mju5odr8aw1hz2uvanblz3xootmvadewlzg5mzixmzi1mtk5njyvudiznzguanbnfdjmymu0m2yzmdhln2i0otk2yzjjmzmwyjdknzexodiyythlmtrmzmi4ymjknjqwm2mzzda2zmfhmmzhztlhmdg.jpeg)
CAS RN: 96184-40-6
4-[trans-4-[(E)-1-Propenyl]cyclohexyl]benzonitrile
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.20251114 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-211915
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: 1g
- Available purity: ≥98%
- 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 |
|---|---|---|---|---|
| 1g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
96184-40-6 / 4-[4-[(E)-prop-1-enyl]cyclohexyl]benzonitrile
Basic Information
CAS
96184-40-6
Multi CAS
Yes
Molecular Formula
C16H19N
Molecular Weight
225.330000
Exact Mass
225.151750
InChI
InChI=1S/C16H19N/c1-2-3-13-4-8-15(9-5-13)16-10-6-14(12-17)7-11-16/h2-3,6-7,10-11,13,15H,4-5,8-9H2,1H3/b3-2+
InChIKey
WFVBLRKVRNUULX-NSCUHMNNSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.44
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
70.67
TPSA
23.79
LogP / Solubility
WLOGP
4.41
MLOGP
3.88
XLogP3
4.8
Consensus LogP
4.36
Log S (ESOL)
-4.14
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.59
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.02
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
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)
-0.96
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
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