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CAS 854045-93-5 (2-BIPHENYL)DI-TERT-BUTYLPHOSPHINE GOLD& molecular structure lightbox
CAS RN: 854045-93-5

(2-BIPHENYL)DI-TERT-BUTYLPHOSPHINE GOLD&

Product Availability

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9 package records7 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250708 100mg Out of stock Inquiry
Batchno.20250122 1g In stock Inquiry
Batchno.20260327 200mg Out of stock Inquiry
Batchno.20250428 250mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251004 100mg / 250mg / 1g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250414 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260218 1g In stock Shanghai Inquiry
Batchno.20260510 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250211 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS854045-93-5
  • Purity/Analytical Methods: >99.0%
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854045-93-5 / chlorogold;ditert-butyl-(2-phenylphenyl)phosphanium

Standard CAS: 854045-93-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
854045-93-5
Multi CAS
Yes
Molecular Formula
C20H28AUCLP
Molecular Weight
531.800000
Exact Mass
531.128286
InChI
InChI=1S/C20H27P.Au.ClH/c1-19(2,3)21(20(4,5)6)18-15-11-10-14-17(18)16-12-8-7-9-13-16;;/h7-15H,1-6H3;;1H/q;+1;
InChIKey
MZMOUYZCJIFYAH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.4
Rotatable bonds
2
Molar refractivity
105.19
TPSA
0.0000

LogP / Solubility

WLOGP
6.48
MLOGP
5.74
XLogP3
6.48
Consensus LogP
6.23
Log S (ESOL)
-7.47
Class (ESOL)
Insoluble
Log S (Ali)
-8.6
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.73
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)
-1.37

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
2.5

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