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CAS 151600-02-1 6-Bromo-2-naphthyl Trifluoromethanesulfonate molecular structure lightbox
CAS RN: 151600-02-1

6-Bromo-2-naphthyl Trifluoromethanesulfonate

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250515 1g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260302 250mg In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250721 25g In stock Shanghai Inquiry
Batchno.20250815 5g In stock Shanghai, Chengdu Inquiry
  • Product code: SSC-061446
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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: ≥95%
  • 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 151600-02-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

151600-02-1 / (6-bromonaphthalen-2-yl) trifluoromethanesulfonate

Standard CAS: 151600-02-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
151600-02-1
Multi CAS
No
Molecular Formula
C11H6BrF3O3S
Molecular Weight
355.130000
Exact Mass
353.917310
SMILES
C1=CC2=C(C=CC(=C2)Br)C=C1OS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C11H6BrF3O3S/c12-9-3-1-8-6-10(4-2-7(8)5-9)18-19(16,17)11(13,14)15/h1-6H
InChIKey
FRNRXKFDZXFNKG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
10
Fraction Csp3
0.09
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
67.25
TPSA
43.37

LogP / Solubility

WLOGP
3.83
MLOGP
3.39
XLogP3
4.6
Consensus LogP
3.94
Log S (ESOL)
-4.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.24
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.39
Class (SILICOS-IT)
Slightly soluble

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)
-2.17

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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