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CAS 984-43-0 1,2-BIS(DIPHENYLPHOSPHINO)ETHANE MONOOXIDE molecular structure lightbox
CAS RN: 984-43-0

1,2-BIS(DIPHENYLPHOSPHINO)ETHANE MONOOXIDE

  • Product code: SSC-212652
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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: ＞97%
  • 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 984-43-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ＞97% 0 Out of Stock Shanghai Inquiry

984-43-0 / 2-diphenylphosphorylethyl(diphenyl)phosphane

Standard CAS: 984-43-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
984-43-0
Multi CAS
Yes
Molecular Formula
C26H24OP2
Molecular Weight
414.400000
Exact Mass
414.130239
InChI
InChI=1S/C26H24OP2/c27-29(25-17-9-3-10-18-25,26-19-11-4-12-20-26)22-21-28(23-13-5-1-6-14-23)24-15-7-2-8-16-24/h1-20H,21-22H2
InChIKey
JCAUAUKUBUBNSB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
24
Fraction Csp3
0.08
Rotatable bonds
7
H-bond acceptors
1
Molar refractivity
128.56
TPSA
17.07

LogP / Solubility

WLOGP
5.13
MLOGP
4.54
XLogP3
5.3
Consensus LogP
4.99
Log S (ESOL)
-5.79
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.66
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.45
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.6

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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