CAS RN: 15300-75-1
9,9-Dibromo-9H-fluorene
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.20250824 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS15300-75-1
- Purity/Analytical Methods: >99.0%
15300-75-1 / 9,9-dibromofluorene
Basic Information
CAS
15300-75-1
Multi CAS
No
Molecular Formula
C13H8Br2
Molecular Weight
324.010000
Exact Mass
323.897230
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C2(Br)Br
InChI
InChI=1S/C13H8Br2/c14-13(15)11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H
InChIKey
UWFJUHQVTXODNQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
12
Fraction Csp3
0.08
Molar refractivity
70.51
TPSA
0.0000
LogP / Solubility
WLOGP
4.66
MLOGP
4.11
XLogP3
4.6
Consensus LogP
4.46
Log S (ESOL)
-5.38
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.63
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)
-1.39
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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