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CAS 1204810-46-7 3,4-Dichloro-6-fluoroquinoline molecular structure lightbox
CAS RN: 1204810-46-7

3,4-Dichloro-6-fluoroquinoline

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250307 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-021504
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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: ＞95%
  • 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 1204810-46-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Shenzhen Inquiry

1204810-46-7 / 3,4-dichloro-6-fluoroquinoline

3,4-Dichloro-6-fluoroquinoline | DTXSID10671169 | RefChem:270838

Standard CAS: 1204810-46-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1204810-46-7
Multi CAS
No
Molecular Formula
C9H4Cl2FN
Molecular Weight
216.040000
Exact Mass
214.970483
SMILES
C1=CC2=NC=C(C(=C2C=C1F)Cl)Cl
InChI
InChI=1S/C9H4Cl2FN/c10-7-4-13-8-2-1-5(12)3-6(8)9(7)11/h1-4H
InChIKey
NGPMJBMQUTZLKP-UHFFFAOYSA-N
Synonyms
3,4-Dichloro-6-fluoroquinoline DTXSID10671169 RefChem:270838 DTXCID20621918 802-575-0

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
H-bond acceptors
1
Molar refractivity
51.72
TPSA
12.89

LogP / Solubility

WLOGP
3.68
MLOGP
3.24
XLogP3
3.5
Consensus LogP
3.47
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-3.99
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.12
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.42

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H302 (97.4%): Harmful if swallowed [Warning Acute toxicity, oral] H318 (97.4%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501

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