[email protected]
CAS 210169-40-7 (S)-(+)-DTBM-SEGPHOS® molecular structure lightbox
CAS RN: 210169-40-7

(S)-(+)-DTBM-SEGPHOS®

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260615 100mg / 500mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250418 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20251007 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250718 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250829 25g In stock Shanghai, Tianjin Inquiry
Batchno.20260621 5g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-099962
GET A QUOTE
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, 0.25g, 1g, 5g
  • Available purity: min. 98%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 210169-40-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g min. 98% 0 Out of Stock Shanghai Inquiry
0.25g min. 98% 0 Out of Stock Shenzhen Inquiry
1g min. 98% 0 Out of Stock Shanghai Inquiry
5g min. 98% 0 Out of Stock Shenzhen Inquiry

210169-40-7 / [4-[5-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphanyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphane

Standard CAS: 210169-40-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
210169-40-7
Multi CAS
No
Molecular Formula
C74H100O8P2
Molecular Weight
1179.500000
Exact Mass
1178.689344
SMILES
CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)P(C2=C(C3=C(C=C2)OCO3)C4=C(C=CC5=C4OCO5)P(C6=CC(=C(C(=C6)C(C)(C)C)OC)C(C)(C)C)C7=CC(=C(C(=C7)C(C)(C)C)OC)C(C)(C)C)C8=CC(=C(C(=C8)C(C)(C)C)OC)C(C)(C)C
InChI
InChI=1S/C74H100O8P2/c1-67(2,3)47-33-43(34-48(61(47)75-25)68(4,5)6)83(44-35-49(69(7,8)9)62(76-26)50(36-44)70(10,11)12)57-31-29-55-65(81-41-79-55)59(57)60-58(32-30-56-66(60)82-42-80-56)84(45-37-51(71(13,14)15)63(77-27)52(38-45)72(16,17)18)46-39-53(73(19,20)21)64(78-28)54(40-46)74(22,23)24/h29-40H,41-42H2,1-28H3
InChIKey
ZNORAFJUESSLTM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
84
Aromatic heavy atom count
36
Fraction Csp3
0.51
Rotatable bonds
11
H-bond acceptors
8
Molar refractivity
357.34
TPSA
73.84

LogP / Solubility

WLOGP
16.74
MLOGP
14.85
XLogP3
21.8
Consensus LogP
17.8
Log S (ESOL)
-17.29
Class (ESOL)
Insoluble
Log S (Ali)
-21.32
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-22.54
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)
1.97

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
6.5

Customers Also Viewed

Get In Touch

Contact Us