![CAS 84337-86-0 4′-BroMo[1,1′-biphenyl]-4-Methanol,4-(4-broMophenyl)phenyl-Methanol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/84337-86-0.gif)
CAS RN: 84337-86-0
4′-BroMo[1,1′-biphenyl]-4-Methanol,4-(4-broMophenyl)phenyl-Methanol
- Product code: SSC-191856
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
84337-86-0 / [4-(4-bromophenyl)phenyl]methanol
Basic Information
CAS
84337-86-0
Multi CAS
No
Molecular Formula
C13H11BRO
Molecular Weight
263.130000
Exact Mass
261.999330
InChI
InChI=1S/C13H11BrO/c14-13-7-5-12(6-8-13)11-3-1-10(9-15)2-4-11/h1-8,15H,9H2
InChIKey
QOBRUMXJJIZUQO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
12
Fraction Csp3
0.08
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
65.5
TPSA
20.23
LogP / Solubility
WLOGP
3.61
MLOGP
3.18
XLogP3
4.1
Consensus LogP
3.63
Log S (ESOL)
-4.2
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.32
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.61
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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