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CAS 103068-20-8 5′-Bromo-m-terphenyl molecular structure lightbox
CAS RN: 103068-20-8

5′-Bromo-m-terphenyl

Product Availability

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250310 10g Out of stock Inquiry
Batchno.20250730 1g In stock Inquiry
Batchno.20250225 25g In stock Inquiry
Batchno.20250212 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251228 5g / 25g / 100g Confirm by inquiry Shanghai, Hebei Inquiry
  • Product code: SSC-004516
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 103068-20-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 2 In Stock Hong Kong Inquiry
5g ≥98% 2 In Stock Shenzhen Inquiry
10g ≥98% 2 In Stock Hong Kong Inquiry
25g ≥98% 1 In Stock Hong Kong Inquiry
100g ≥98% 0 Out of Stock Shenzhen Inquiry

103068-20-8 / 1-bromo-3,5-diphenylbenzene

5'-Bromo-1,1':3',1''-terphenyl | RefChem:527457 | 822-230-8

Standard CAS: 103068-20-8 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
103068-20-8
Multi CAS
No
Molecular Formula
C18H13Br
Molecular Weight
309.200000
Exact Mass
308.020060
SMILES
C1=CC=C(C=C1)C2=CC(=CC(=C2)Br)C3=CC=CC=C3
InChI
InChI=1S/C18H13Br/c19-18-12-16(14-7-3-1-4-8-14)11-17(13-18)15-9-5-2-6-10-15/h1-13H
InChIKey
IOPQERQQZZREDR-UHFFFAOYSA-N
Synonyms
5'-Bromo-1,1':3',1''-terphenyl RefChem:527457 822-230-8 1-Bromo-3,5-diphenylbenzene 5'-Bromo-m-terphenyl

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
18
Rotatable bonds
2
Molar refractivity
85.01
TPSA
0.0000

LogP / Solubility

WLOGP
5.78
MLOGP
5.1
XLogP3
5.9
Consensus LogP
5.59
Log S (ESOL)
-5.97
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.27
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.71
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
-0.5

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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