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CAS 155041-85-3 trans,trans-4-(4-Methylphenyl)-4′-vinylbicyclohexyl molecular structure lightbox
CAS RN: 155041-85-3

trans,trans-4-(4-Methylphenyl)-4′-vinylbicyclohexyl

Product Availability

Choose a grade to view its available package options.

6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250902 100g Out of stock Inquiry
Batchno.20250420 10g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250116 1g In stock Shanghai Inquiry
Batchno.20250117 1g / 5g / 25g / 100g Confirm by inquiry Shandong, Guangdong Inquiry
Batchno.20250109 25g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250322 5g In stock Shanghai Inquiry
  • Product code: SSC-064361
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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: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 155041-85-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

155041-85-3 / 1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene

Standard CAS: 155041-85-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
155041-85-3
Multi CAS
No
Molecular Formula
C21H30
Molecular Weight
282.500000
Exact Mass
282.234751
SMILES
CC1=CC=C(C=C1)C2CCC(CC2)C3CCC(CC3)C=C
InChI
InChI=1S/C21H30/c1-3-17-6-10-19(11-7-17)21-14-12-20(13-15-21)18-8-4-16(2)5-9-18/h3-5,8-9,17,19-21H,1,6-7,10-15H2,2H3
InChIKey
BCUMFFLWJNKNOU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
6
Fraction Csp3
0.62
Rotatable bonds
3
Molar refractivity
91.52
TPSA
0.0000

LogP / Solubility

WLOGP
6.26
MLOGP
5.52
XLogP3
7.6
Consensus LogP
6.46
Log S (ESOL)
-5.55
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.4
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.05
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

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Health Hazard
Signal
Warning
GHS Hazard Statements
H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
Precautionary Statement Codes
P260, P319, and P501

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