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CAS 1000391-24-1 6-Bromo-1-chloronaphthalene molecular structure lightbox
CAS RN: 1000391-24-1

6-Bromo-1-chloronaphthalene

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260111 100mg In stock Shanghai Inquiry
Batchno.20250315 1g In stock Shanghai Inquiry
Batchno.20260222 1g In stock Shanghai Inquiry
Batchno.20250819 250mg In stock Shanghai Inquiry
Batchno.20260501 5g In stock Shanghai Inquiry
  • Product code: SSC-000179
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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 1000391-24-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

1000391-24-1 / 6-bromo-1-chloronaphthalene

6-bromo-1-chloronaphthalene | 1000391-24-1 | 2-Bromo-5-chloronaphthalene

Standard CAS: 1000391-24-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1000391-24-1
Multi CAS
No
Molecular Formula
C10H6BrCl
Molecular Weight
241.510000
Exact Mass
239.934140
SMILES
C1=CC2=C(C=CC(=C2)Br)C(=C1)Cl
InChI
InChI=1S/C10H6BrCl/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h1-6H
InChIKey
KUQJGFGVAJMCNG-UHFFFAOYSA-N
Synonyms
6-bromo-1-chloronaphthalene 1000391-24-1 2-Bromo-5-chloronaphthalene 6-bromo-1-chloro-naphthalene MFCD18410264

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
10
Molar refractivity
56.66
TPSA
0.0000

LogP / Solubility

WLOGP
4.26
MLOGP
3.75
XLogP3
4.6
Consensus LogP
4.2
Log S (ESOL)
-4.64
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.61
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.76
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.17

Drug-likeness / Medicinal Chemistry

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

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