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CAS 5866-97-7 2,6-Dichloro-3-nitrobenzaldehyde molecular structure lightbox
CAS RN: 5866-97-7

2,6-Dichloro-3-nitrobenzaldehyde

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260309 100g In stock Inquiry
Batchno.20260308 1g In stock Inquiry
Batchno.20251016 25g In stock Inquiry
Batchno.20250707 5g In stock Inquiry
  • Product code: SSC-166980
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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: 100g
  • 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 5866-97-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Hong Kong Inquiry

5866-97-7 / 2,6-dichloro-3-nitrobenzaldehyde

Standard CAS: 5866-97-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
5866-97-7
Multi CAS
No
Molecular Formula
C7H3CL2NO3
Molecular Weight
220.010000
Exact Mass
218.948998
InChI
InChI=1S/C7H3Cl2NO3/c8-5-1-2-6(10(12)13)7(9)4(5)3-11/h1-3H
InChIKey
CQOQHGBSJIWOCA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
48.5
TPSA
60.21

LogP / Solubility

WLOGP
2.71
MLOGP
2.39
XLogP3
2.4
Consensus LogP
2.5
Log S (ESOL)
-3.12
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.32
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.58
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.14

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

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