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CAS 66996-59-6 1,6-DIBROMO-2-METHOXYNAPHTHALENE molecular structure lightbox
CAS RN: 66996-59-6

1,6-DIBROMO-2-METHOXYNAPHTHALENE

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260512 100mg In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250423 1g In stock Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20260503 250mg In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260311 5g In stock Wuhan Inquiry
  • Product code: SSC-176642
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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 66996-59-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

66996-59-6 / 1,6-dibromo-2-methoxynaphthalene

Standard CAS: 66996-59-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
66996-59-6
Multi CAS
No
Molecular Formula
C11H8BR2O
Molecular Weight
315.990000
Exact Mass
315.892140
InChI
InChI=1S/C11H8Br2O/c1-14-10-5-2-7-6-8(12)3-4-9(7)11(10)13/h2-6H,1H3
InChIKey
HFEOLDKRKNUVAD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
Fraction Csp3
0.09
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
65.9
TPSA
9.23

LogP / Solubility

WLOGP
4.37
MLOGP
3.86
XLogP3
4.5
Consensus LogP
4.24
Log S (ESOL)
-5.02
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.46
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
No
Log Kp (skin permeation)
-1.54

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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