CAS RN: 10368-73-7
2′-Bromo-5′-phenyl-1,1′:3′,1”-terphenyl
Product Availability
Choose a grade to view its available package options.
8 package records5 with current stock2 grade groups
- Product code: SSC-005269
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
- Available purity: >97%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
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10368-73-7 / 2-bromo-1,3,5-triphenylbenzene
2'-Bromo-5'-phenyl-1,1':3',1''-terphenyl | RefChem:439575 | 659-706-8
Basic Information
CAS
10368-73-7
Multi CAS
Yes
Molecular Formula
C24H17Br
Molecular Weight
385.300000
Exact Mass
384.051360
SMILES
C1=CC=C(C=C1)C2=CC(=C(C(=C2)C3=CC=CC=C3)Br)C4=CC=CC=C4
InChI
InChI=1S/C24H17Br/c25-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20/h1-17H
InChIKey
JQAGNDRJKSDTEU-UHFFFAOYSA-N
Synonyms
2'-Bromo-5'-phenyl-1,1':3',1''-terphenyl
RefChem:439575
659-706-8
2-bromo-1,3,5-triphenylbenzene
2-bromo-1,3,5-triphenyl-benzene
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
24
Rotatable bonds
3
Molar refractivity
110.45
TPSA
0.0000
LogP / Solubility
WLOGP
7.45
MLOGP
6.58
XLogP3
7.5
Consensus LogP
7.18
Log S (ESOL)
-7.43
Class (ESOL)
Insoluble
Log S (Ali)
-8.1
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.71
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
Yes
Log Kp (skin permeation)
0.22
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (97.4%): Harmful if swallowed [Warning Acute toxicity, oral]
H319 (97.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501
