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CAS 32761-50-5 [TRIS(DIMETHYLPHENYLPHOSPHINE)](2,5-NORBORNADIENE)RHODIUM(I) HEXAFLUOROPHOSPHATE molecular structure lightbox
CAS RN: 32761-50-5

[TRIS(DIMETHYLPHENYLPHOSPHINE)](2,5-NORBORNADIENE)RHODIUM(I) HEXAFLUOROPHOSPHATE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251019 100mg / 500mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS32761-50-5
  • Purity/Analytical Methods: >99.0%
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32761-50-5 / bicyclo[2.2.1]hepta-2,5-diene;tris(dimethyl(phenyl)phosphane);rhodium;hexafluorophosphate

Standard CAS: 32761-50-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
32761-50-5
Multi CAS
Yes
Molecular Formula
C31F6H41P4Rh
Molecular Weight
754.400000
Exact Mass
754.111790
InChI
InChI=1S/3C8H11P.C7H8.F6P.Rh/c3*1-9(2)8-6-4-3-5-7-8;1-2-7-4-3-6(1)5-7;1-7(2,3,4,5)6;/h3*3-7H,1-2H3;1-4,6-7H,5H2;;/q;;;;-1;
InChIKey
VMMJZDCWYNRZKV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
42
Aromatic heavy atom count
18
Fraction Csp3
0.29
Rotatable bonds
3
H-bond acceptors
7
Molar refractivity
177.98
TPSA
0.0000

LogP / Solubility

WLOGP
11.29
MLOGP
10
XLogP3
11.29
Consensus LogP
10.86
Log S (ESOL)
-11.75
Class (ESOL)
Insoluble
Log S (Ali)
-13.9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-14.29
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
0.69

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7

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