CAS RN: 148432-44-4
DI-2-NORBORNYLPHOSPHINE
Product Availability
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3 package records2 with current stock1 grade group
- Product code: starshine_CAS148432-44-4
- Purity/Analytical Methods: >99.0%
148432-44-4 / bis(2-bicyclo[2.2.1]heptanyl)phosphane
Basic Information
CAS
148432-44-4
Multi CAS
No
Molecular Formula
C14H23P
Molecular Weight
222.310000
Exact Mass
222.153738
SMILES
C1CC2CC1CC2PC3CC4CCC3C4
InChI
InChI=1S/C14H23P/c1-3-11-5-9(1)7-13(11)15-14-8-10-2-4-12(14)6-10/h9-15H,1-8H2
InChIKey
HTYNGYAEADUMOE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
2
Molar refractivity
66.79
TPSA
0.0000
LogP / Solubility
WLOGP
4.04
MLOGP
3.56
XLogP3
3.4
Consensus LogP
3.67
Log S (ESOL)
-3.63
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.7
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)
-1.21
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
9
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- Product Code: starshine_CAS148451-96-1
- Purity/Analytical method: >99.0%
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