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CAS 829-84-5 DICYCLOHEXYLPHOSPHINE molecular structure lightbox
CAS RN: 829-84-5

DICYCLOHEXYLPHOSPHINE

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250810 1g In stock Inquiry
Batchno.20250825 250mg In stock Inquiry
Batchno.20250821 5g In stock Inquiry
  • Product code: starshine_CAS829-84-5
  • Purity/Analytical Methods: >99.0%
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829-84-5 / dicyclohexylphosphane

Standard CAS: 829-84-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
829-84-5
Multi CAS
No
Molecular Formula
C12H23P
Molecular Weight
198.280000
Exact Mass
198.153738
InChI
InChI=1S/C12H23P/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2
InChIKey
HDULBKVLSJEMGN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
1
Rotatable bonds
2
Molar refractivity
62.06
TPSA
0.0000

LogP / Solubility

WLOGP
4.33
MLOGP
3.81
XLogP3
3.5
Consensus LogP
3.88
Log S (ESOL)
-3.67
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.78
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)
-0.86

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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