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CAS 101335-11-9 2-CHLORO-4-FLUOROIODOBENZENE molecular structure lightbox
CAS RN: 101335-11-9

2-CHLORO-4-FLUOROIODOBENZENE

Product Availability

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12 package records12 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251228 100g In stock Inquiry
Batchno.20260109 25g In stock Inquiry
Batchno.20250122 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250219 100g In stock Inquiry
Batchno.20250706 1g In stock Inquiry
Batchno.20260217 25g In stock Inquiry
Batchno.20250220 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250824 100g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20260314 10g In stock Shanghai Inquiry
Batchno.20250421 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251209 500g In stock Shenzhen, Tianjin Inquiry
Batchno.20251021 5g In stock Shanghai, Tianjin, Chengdu Inquiry
  • Product code: SSC-002183
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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: ≥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 101335-11-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Hong Kong Inquiry

101335-11-9 / 2-chloro-4-fluoro-1-iodobenzene

2-chloro-4-fluoro-1-iodobenzene | 2-Chloro-4-fluoroiodobenzene | DTXSID20371441

Standard CAS: 101335-11-9 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
101335-11-9
Multi CAS
No
Molecular Formula
C6H3ClFI
Molecular Weight
256.440000
Exact Mass
255.895200
SMILES
C1=CC(=C(C=C1F)Cl)I
InChI
InChI=1S/C6H3ClFI/c7-5-3-4(8)1-2-6(5)9/h1-3H
InChIKey
POTCKVPDYXEGSV-UHFFFAOYSA-N
Synonyms
2-chloro-4-fluoro-1-iodobenzene 2-Chloro-4-fluoroiodobenzene DTXSID20371441 RefChem:468961 DTXCID40322475

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
1
Molar refractivity
44.13
TPSA
0.0000

LogP / Solubility

WLOGP
3.08
MLOGP
2.72
XLogP3
3.3
Consensus LogP
3.03
Log S (ESOL)
-3.87
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.89
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.89
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)
-2.09

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (14.3%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (14.3%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (14.3%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (85.7%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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