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CAS 129738-42-7 trans,trans-4′-(3-Butenyl)-4-(p-tolyl)bicyclohexyl molecular structure lightbox
CAS RN: 129738-42-7

trans,trans-4′-(3-Butenyl)-4-(p-tolyl)bicyclohexyl

Product Availability

Choose a grade to view its available package options.

8 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250804 100mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250405 1g In stock Shanghai Inquiry
Batchno.20250703 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250924 25g In stock Wuhan, Chengdu Inquiry
Batchno.20250110 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260131 1g In stock Shanghai, Hebei Inquiry
Batchno.20250126 25g Out of stock 8-10 business days Inquiry
Batchno.20251124 5g In stock Shanghai Inquiry
  • Product code: SSC-036588
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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: 10g
  • Available purity: ≥98%
  • 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 129738-42-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥98% 0 Out of Stock Shanghai Inquiry

129738-42-7 / 1-[4-(4-but-3-enylcyclohexyl)cyclohexyl]-4-methylbenzene

Standard CAS: 129738-42-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
129738-42-7
Multi CAS
No
Molecular Formula
C23H34
Molecular Weight
310.500000
Exact Mass
310.266051
SMILES
CC1=CC=C(C=C1)C2CCC(CC2)C3CCC(CC3)CCC=C
InChI
InChI=1S/C23H34/c1-3-4-5-19-8-12-21(13-9-19)23-16-14-22(15-17-23)20-10-6-18(2)7-11-20/h3,6-7,10-11,19,21-23H,1,4-5,8-9,12-17H2,2H3
InChIKey
OXPUOKDPOMJNKA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
6
Fraction Csp3
0.65
Rotatable bonds
5
Molar refractivity
100.76
TPSA
0.0000

LogP / Solubility

WLOGP
7.04
MLOGP
6.21
XLogP3
8.6
Consensus LogP
7.28
Log S (ESOL)
-6.06
Class (ESOL)
Insoluble
Log S (Ali)
-7.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.12
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
0.39

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

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