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CAS 146862-02-4 4-(trans-4-Propylcyclohexyl)phenylboronic Acid (contains varying amounts of Anhydride) molecular structure lightbox
CAS RN: 146862-02-4

4-(trans-4-Propylcyclohexyl)phenylboronic Acid (contains varying amounts of Anhydride)

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251016 100g In stock Shanghai Inquiry
Batchno.20260401 10g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20251011 25g In stock Shanghai, Tianjin Inquiry
Batchno.20260611 5g In stock Shanghai Inquiry
  • Product code: SSC-057757
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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: ≥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 146862-02-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Beijing Inquiry

146862-02-4 / [4-(4-propylcyclohexyl)phenyl]boronic acid

Standard CAS: 146862-02-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
146862-02-4
Multi CAS
No
Molecular Formula
C15H23BO2
Molecular Weight
246.150000
Exact Mass
246.179110
SMILES
B(C1=CC=C(C=C1)C2CCC(CC2)CCC)(O)O
InChI
InChI=1S/C15H23BO2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h8-13,17-18H,2-7H2,1H3
InChIKey
QTBUVZSHCNAPRT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.6
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
75.87
TPSA
40.46

LogP / Solubility

WLOGP
2.44
MLOGP
2.15
XLogP3
2.44
Consensus LogP
2.34
Log S (ESOL)
-2.89
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.34
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.77
Class (SILICOS-IT)
Poorly 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)
-2.49

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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