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CAS 134150-03-1 4′-BROMO-4-(TRIFLUOROMETHOXY)BIPHENYL molecular structure lightbox
CAS RN: 134150-03-1

4′-BROMO-4-(TRIFLUOROMETHOXY)BIPHENYL

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250726 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-041501
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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: 1g
  • Available purity: ≥95%
  • 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 134150-03-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

134150-03-1 / 1-bromo-4-[4-(trifluoromethoxy)phenyl]benzene

Standard CAS: 134150-03-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
134150-03-1
Multi CAS
No
Molecular Formula
C13H8BrF3O
Molecular Weight
317.100000
Exact Mass
315.971060
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)Br)OC(F)(F)F
InChI
InChI=1S/C13H8BrF3O/c14-11-5-1-9(2-6-11)10-3-7-12(8-4-10)18-13(15,16)17/h1-8H
InChIKey
SOJDIXJKGSONDR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.08
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
66.26
TPSA
9.23

LogP / Solubility

WLOGP
5.01
MLOGP
4.43
XLogP3
6.2
Consensus LogP
5.21
Log S (ESOL)
-5.33
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.78
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.12
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.09

Drug-likeness / Medicinal Chemistry

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

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