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CAS 3592-25-4 1 5-DICHLORO-3-PENTANONE molecular structure lightbox
CAS RN: 3592-25-4

1 5-DICHLORO-3-PENTANONE

  • Product code: SSC-142996
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 5g, 10g, 100g, 25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 5
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 3592-25-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >95% 5 In Stock Shenzhen Inquiry
10g >95% 5 In Stock Shenzhen Inquiry
100g >95% 5 In Stock Hong Kong Inquiry
25g >95% 4 In Stock Beijing Inquiry
1g >95% 3 In Stock Shanghai Inquiry

3592-25-4 / 1,5-dichloropentan-3-one

Standard CAS: 3592-25-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3592-25-4
Multi CAS
Yes
Molecular Formula
C5H8CL2O
Molecular Weight
155.020000
Exact Mass
153.995220
InChI
InChI=1S/C5H8Cl2O/c6-3-1-5(8)2-4-7/h1-4H2
InChIKey
LYJQMHVYFFZQGY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.8
Rotatable bonds
4
H-bond acceptors
1
Molar refractivity
35.68
TPSA
17.07

LogP / Solubility

WLOGP
1.81
MLOGP
1.59
XLogP3
1
Consensus LogP
1.47
Log S (ESOL)
-1.68
Class (ESOL)
Soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.65
Class (SILICOS-IT)
Moderately 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)
-2.38

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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