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CAS 898807-69-7 Dichloro[9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene]Cobalt(II), min. 98% molecular structure lightbox
CAS RN: 898807-69-7

Dichloro[9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene]Cobalt(II), min. 98%

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260126 1g In stock Shanghai Inquiry
Batchno.20260515 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20251119 500mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20251217 5g In stock Shanghai Inquiry
  • Product code: SSC-202060
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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: 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 898807-69-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

898807-69-7 / cobalt;(5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane;dihydrochloride

Standard CAS: 898807-69-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
898807-69-7
Multi CAS
Yes
Molecular Formula
C39H34CL2COOP2
Molecular Weight
710.500000
Exact Mass
709.079389
InChI
InChI=1S/C39H32OP2.2ClH.Co/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;;;/h3-28H,1-2H3;2*1H;/q;;;+2/p-2
InChIKey
WLCNMTVTMBAJEN-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
45
Aromatic heavy atom count
36
Fraction Csp3
0.08
Rotatable bonds
6
H-bond acceptors
1
H-bond donors
2
Molar refractivity
196.99
TPSA
9.23

LogP / Solubility

WLOGP
8.48
MLOGP
7.52
XLogP3
8.48
Consensus LogP
8.16
Log S (ESOL)
-9.78
Class (ESOL)
Insoluble
Log S (Ali)
-11.51
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.03
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)
-1.04

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
6

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