CAS RN: 32673-25-9
Di-tert-butylphenylphosphine
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: ICTD3940
- Purity/Analytical Methods: >97.0%(GC)
32673-25-9 / ditert-butyl(phenyl)phosphane
Basic Information
CAS
32673-25-9
Multi CAS
No
Molecular Formula
C14H23P
Molecular Weight
222.310000
Exact Mass
222.153738
InChI
InChI=1S/C14H23P/c1-13(2,3)15(14(4,5)6)12-10-8-7-9-11-12/h7-11H,1-6H3
InChIKey
XOJNEFQLMRCOMS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.57
Rotatable bonds
1
Molar refractivity
72.5
TPSA
0.0000
LogP / Solubility
WLOGP
4.39
MLOGP
3.87
XLogP3
3.5
Consensus LogP
3.92
Log S (ESOL)
-4.21
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.55
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.87
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.96
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
Customers Also Viewed
-
-
-
Tris[3,5-bis(trifluoromethyl)phenyl]phosphine
- CAS RN: 175136-62-6
- Product Code: SSC-076789
-
-
-
![CAS 175136-62-6 Tris[3,5-bis(trifluoromethyl)phenyl]phosphine molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t2526-jpgcontextbwfzdgvyfhjvb3r8mzg3ndb8aw1hz2uvanblz3xoymmvagmwlzg5mzi1oty3mte0ntqvvdi1mjyuanbnfdqyn2vkztg3mju1zgq4mzgynta5zgq2nwjimgqwmzfmnwuzztezywfjnju0owfmmzq2ntnjogmwmtg4zjzlzgi.jpeg)
