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CAS 325773-62-4 2,2′-Bis[bis(3,5-dimethylphenyl)phosphino]-1,1′-biphenyl molecular structure lightbox
CAS RN: 325773-62-4

2,2′-Bis[bis(3,5-dimethylphenyl)phosphino]-1,1′-biphenyl

  • Product code: SSC-138187
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 325773-62-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Beijing Inquiry

325773-62-4 / [2-[2-bis(3,5-dimethylphenyl)phosphanylphenyl]phenyl]-bis(3,5-dimethylphenyl)phosphane

Standard CAS: 325773-62-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
325773-62-4
Multi CAS
No
Molecular Formula
C44H44P2
Molecular Weight
634.800000
Exact Mass
634.291825
InChI
InChI=1S/C44H44P2/c1-29-17-30(2)22-37(21-29)45(38-23-31(3)18-32(4)24-38)43-15-11-9-13-41(43)42-14-10-12-16-44(42)46(39-25-33(5)19-34(6)26-39)40-27-35(7)20-36(8)28-40/h9-28H,1-8H3
InChIKey
UDNDZWUGMDKYNK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
46
Aromatic heavy atom count
36
Fraction Csp3
0.18
Rotatable bonds
7
Molar refractivity
207.19
TPSA
0.0000

LogP / Solubility

WLOGP
9.34
MLOGP
8.27
XLogP3
11.8
Consensus LogP
9.8
Log S (ESOL)
-9.78
Class (ESOL)
Insoluble
Log S (Ali)
-11.51
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.38
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)
0.04

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
5.5

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