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CAS 1599466-83-7 Methanesulfonato(2-dicyclohexylphosphino-3,6-dimethoxy-2′,4′,6′-tri-i-propyl-1,1′-biphenyl)(2′-methylamino-1,1′-biphenyl-2-yl)palladium(II) molecular structure lightbox
CAS RN: 1599466-83-7

Methanesulfonato(2-dicyclohexylphosphino-3,6-dimethoxy-2′,4′,6′-tri-i-propyl-1,1′-biphenyl)(2′-methylamino-1,1′-biphenyl-2-yl)palladium(II)

Product Availability

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15 package records8 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250508 50mg / 250mg / 1g / 5g Confirm by inquiry Shanghai 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251119 100g In stock Shanghai Inquiry
Batchno.20251231 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260401 10g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250729 1g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20260608 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20250307 25g In stock Shanghai, Tianjin Inquiry
Batchno.20251122 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260504 100g Out of stock Inquiry
Batchno.20260419 100mg Out of stock Inquiry
Batchno.20260308 10g Out of stock Inquiry
Batchno.20250102 1g Out of stock Inquiry
Batchno.20251221 250mg Out of stock Inquiry
Batchno.20260315 25g Out of stock Inquiry
Batchno.20250225 5g Out of stock Inquiry
  • Product code: SSC-067935
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Verified Factory Data

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Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 1g, 10g, 0.25g, 5g, 25g
  • Available purity: 98.00-102.00%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1599466-83-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g 98.00-102.00% 5 In Stock Shenzhen Inquiry
1g 98.00-102.00% 5 In Stock Hong Kong Inquiry
10g 98.00-102.00% 5 In Stock Shanghai Inquiry
0.25g 98.00-102.00% 4 In Stock Shenzhen Inquiry
5g 98.00-102.00% 2 In Stock Beijing Inquiry
25g 98.00-102.00% 2 In Stock Hong Kong Inquiry

1599466-83-7 / dicyclohexyl-[3,6-dimethoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane;methanesulfonic acid;N-methyl-2-phenylaniline;palladium

Standard CAS: 1599466-83-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1599466-83-7
Multi CAS
No
Molecular Formula
C49H69NO5PPdS-
Molecular Weight
921.500000
Exact Mass
920.366890
SMILES
CC(C)C1=CC(=C(C(=C1)C(C)C)C2=C(C=CC(=C2P(C3CCCCC3)C4CCCCC4)OC)OC)C(C)C.CNC1=CC=CC=C1C2=CC=CC=[C-]2.CS(=O)(=O)O.[Pd]
InChI
InChI=1S/C35H53O2P.C13H12N.CH4O3S.Pd/c1-23(2)26-21-29(24(3)4)33(30(22-26)25(5)6)34-31(36-7)19-20-32(37-8)35(34)38(27-15-11-9-12-16-27)28-17-13-10-14-18-28;1-14-13-10-6-5-9-12(13)11-7-3-2-4-8-11;1-5(2,3)4;/h19-25,27-28H,9-18H2,1-8H3;2-7,9-10,14H,1H3;1H3,(H,2,3,4);/q;-1;;
InChIKey
YGIUDYZKEHOKOY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
58
Aromatic heavy atom count
24
Fraction Csp3
0.51
Rotatable bonds
11
H-bond acceptors
5
H-bond donors
2
Molar refractivity
245.28
TPSA
84.86

LogP / Solubility

WLOGP
13.21
MLOGP
11.71
XLogP3
13.21
Consensus LogP
12.71
Log S (ESOL)
-13.46
Class (ESOL)
Insoluble
Log S (Ali)
-16.65
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-17.93
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1.04

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H412 (66.7%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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