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CAS 211734-49-5 (R)-3,3′-Dibromo-2,2′-bis(meth molecular structure lightbox
CAS RN: 211734-49-5

(R)-3,3′-Dibromo-2,2′-bis(meth

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250723 1g / 5g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251118 1g In stock Shanghai Inquiry
Batchno.20250131 250mg In stock Shanghai, Wuhan Inquiry
Batchno.20250829 5g In stock Shanghai Inquiry
  • Product code: SSC-101150
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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: 5g
  • Available purity: >98%
  • 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 211734-49-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >98% 0 Out of Stock Shanghai Inquiry

211734-49-5 / 3-bromo-1-[3-bromo-2-(methoxymethoxy)naphthalen-1-yl]-2-(methoxymethoxy)naphthalene

Standard CAS: 211734-49-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
211734-49-5
Multi CAS
No
Molecular Formula
C24H20Br2O4
Molecular Weight
532.200000
Exact Mass
531.970780
SMILES
COCOC1=C(C2=CC=CC=C2C=C1Br)C3=C(C(=CC4=CC=CC=C43)Br)OCOC
InChI
InChI=1S/C24H20Br2O4/c1-27-13-29-23-19(25)11-15-7-3-5-9-17(15)21(23)22-18-10-6-4-8-16(18)12-20(26)24(22)30-14-28-2/h3-12H,13-14H2,1-2H3
InChIKey
GBVXBVQRXNQXPL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
20
Fraction Csp3
0.17
Rotatable bonds
7
H-bond acceptors
4
Molar refractivity
127.3
TPSA
36.92

LogP / Solubility

WLOGP
7.15
MLOGP
6.33
XLogP3
7.3
Consensus LogP
6.93
Log S (ESOL)
-7.68
Class (ESOL)
Insoluble
Log S (Ali)
-9.09
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.89
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)
-0.89

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
3

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