![CAS 316-61-0 2′-FLUORO[1,1′-BIPHENYL]-2-AMINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB0398217(1).gif)
CAS RN: 316-61-0
2′-FLUORO[1,1′-BIPHENYL]-2-AMINE
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.20251231 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS316-61-0
- Purity/Analytical Methods: >99.0%
316-61-0 / 2-(2-fluorophenyl)aniline
Basic Information
CAS
316-61-0
Multi CAS
No
Molecular Formula
C12FH10N
Molecular Weight
187.210000
Exact Mass
187.079727
InChI
InChI=1S/C12H10FN/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H,14H2
InChIKey
FMELKKXQAQGQMA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
56.25
TPSA
26.02
LogP / Solubility
WLOGP
3.07
MLOGP
2.7
XLogP3
2.9
Consensus LogP
2.89
Log S (ESOL)
-3.51
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.32
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.55
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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- CAS RN: 317-55-5
- Product Code: starshine_CAS317-55-5
- Purity/Analytical method: >99.0%
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