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CAS 2163-00-0 1,6-Dichlorohexane molecular structure lightbox
CAS RN: 2163-00-0

1,6-Dichlorohexane

Product Availability

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2 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260224 500g Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260113 25g / 100g / 500g / 2.5kg / 10kg Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei, Chongqing Inquiry
  • Product code: SSC-103645
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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: 500g
  • 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 2163-00-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ≥97% 0 Out of Stock Hong Kong Inquiry

2163-00-0 / 1,6-dichlorohexane

Standard CAS: 2163-00-0 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
2163-00-0
Multi CAS
No
Molecular Formula
C6H12Cl2
Molecular Weight
155.060000
Exact Mass
154.031606
SMILES
C(CCCCl)CCCl
InChI
InChI=1S/C6H12Cl2/c7-5-3-1-2-4-6-8/h1-6H2
InChIKey
OVISMSJCKCDOPU-UHFFFAOYSA-N

Physical Properties

Density
1.068 at 68 °F (USCG, 1999) - Denser than water; will sink
Physical Description
1,6-dichlorohexane is a colorless liquid. (USCG, 1999) Liquid Colorless liquid; [CAMEO] Clear slightly yellow liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
Rotatable bonds
5
Molar refractivity
39.91
TPSA
0.0000

LogP / Solubility

WLOGP
3.02
MLOGP
2.66
XLogP3
2.8
Consensus LogP
2.83
Log S (ESOL)
-2.38
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.02
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.78
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)
-1.52

Drug-likeness / Medicinal Chemistry

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

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