CAS RN: 6411-21-8
1,2-BIS(DIETHYLPHOSPHINO)ETHANE
Product Availability
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3 package records2 with current stock1 grade group
- Product code: starshine_CAS6411-21-8
- Purity/Analytical Methods: >99.0%
6411-21-8 / 2-diethylphosphanylethyl(diethyl)phosphane
Basic Information
CAS
6411-21-8
Multi CAS
No
Molecular Formula
C10H24P2
Molecular Weight
206.240000
Exact Mass
206.135325
InChI
InChI=1S/C10H24P2/c1-5-11(6-2)9-10-12(7-3)8-4/h5-10H2,1-4H3
InChIKey
MIOCUERTSIJEDP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
7
Molar refractivity
65.74
TPSA
0.0000
LogP / Solubility
WLOGP
4.03
MLOGP
3.55
XLogP3
1.1
Consensus LogP
2.89
Log S (ESOL)
-3.2
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.19
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)
-1.12
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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