CAS RN: 29334-18-7
4,4′-DIBROMOBENZHYDROL
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251228 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS29334-18-7
- Purity/Analytical Methods: >99.0%
29334-18-7 / bis(4-bromophenyl)methanol
Basic Information
CAS
29334-18-7
Multi CAS
Yes
Molecular Formula
C13H10BR2O
Molecular Weight
342.020000
Exact Mass
341.907790
InChI
InChI=1S/C13H10Br2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13,16H
InChIKey
PDQRNCTWDZPBGQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
12
Fraction Csp3
0.08
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
72.35
TPSA
20.23
LogP / Solubility
WLOGP
4.29
MLOGP
3.8
XLogP3
4.1
Consensus LogP
4.06
Log S (ESOL)
-5.09
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.46
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.69
Class (SILICOS-IT)
Slightly soluble
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)
-1.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
3-CHLORO-6-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)PYRIDAZINE
- CAS RN: 29334-67-6
- Product Code: SSC-132011
-
-
-
-
2,4,6-Cycloheptatrien-1-one, 2,3-dihydroxy-5-(1-Methylethyl)-
- CAS RN: 29346-20-1
- Product Code: starshine_CAS29346-20-1
- Purity/Analytical method: >99.0%
![CAS 29342-65-2 Bicyclo[2.2.1]heptane, 2-bromo- (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/29342-65-2.gif)
