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CAS 2033-29-6 5,6-Dichloro-1H-benzo[d]imidazol-2(3H)-one molecular structure lightbox
CAS RN: 2033-29-6

5,6-Dichloro-1H-benzo[d]imidazol-2(3H)-one

Product Availability

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260301 100mg In stock Inquiry
Batchno.20250928 10g In stock Inquiry
Batchno.20250615 1g In stock Inquiry
Batchno.20250202 250mg In stock Inquiry
Batchno.20250119 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250530 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-095710
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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 2033-29-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

2033-29-6 / 5,6-dichloro-1,3-dihydrobenzimidazol-2-one

Standard CAS: 2033-29-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
2033-29-6
Multi CAS
No
Molecular Formula
C7H4Cl2N2O
Molecular Weight
203.020000
Exact Mass
201.970068
SMILES
C1=C2C(=CC(=C1Cl)Cl)NC(=O)N2
InChI
InChI=1S/C7H4Cl2N2O/c8-3-1-5-6(2-4(3)9)11-7(12)10-5/h1-2H,(H2,10,11,12)
InChIKey
HQBYAESCKCDTDJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
2
Molar refractivity
48.94
TPSA
48.65

LogP / Solubility

WLOGP
2.16
MLOGP
1.9
XLogP3
1.8
Consensus LogP
1.95
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.79
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.77
Class (SILICOS-IT)
Moderately 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)
-2.42

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)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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