[email protected]
CAS 7253-07-8 (9-FLUORENYL)TRIPHENYLPHOSPHONIUM BROMIDE molecular structure lightbox
CAS RN: 7253-07-8

(9-FLUORENYL)TRIPHENYLPHOSPHONIUM BROMIDE

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251207 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS7253-07-8
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

7253-07-8 / 9H-fluoren-9-yl(triphenyl)phosphanium bromide

Standard CAS: 7253-07-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7253-07-8
Multi CAS
Yes
Molecular Formula
C31H24BRP
Molecular Weight
507.400000
Exact Mass
506.079900
InChI
InChI=1S/C31H24P.BrH/c1-4-14-24(15-5-1)32(25-16-6-2-7-17-25,26-18-8-3-9-19-26)31-29-22-12-10-20-27(29)28-21-11-13-23-30(28)31;/h1-23,31H;1H/q+1;/p-1
InChIKey
BHNPKGAMAZKCCJ-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
33
Aromatic heavy atom count
30
Fraction Csp3
0.03
Rotatable bonds
4
H-bond acceptors
1
Molar refractivity
138.87
TPSA
0.0000

LogP / Solubility

WLOGP
3.75
MLOGP
3.34
XLogP3
3.75
Consensus LogP
3.61
Log S (ESOL)
-5.76
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.43
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.55
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.15

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
4

Customers Also Viewed

Get In Touch

Contact Us