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CAS 13214-53-4 2-Oxo-1-imidazolidinecarbonyl Chloride molecular structure lightbox
CAS RN: 13214-53-4

2-Oxo-1-imidazolidinecarbonyl Chloride

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251208 1g In stock Shanghai Inquiry
Batchno.20250309 25g In stock Shanghai Inquiry
Batchno.20250405 5g In stock Shanghai Inquiry
  • Product code: SSC-039146
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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: 5g
  • 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 13214-53-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞95% 0 Out of Stock Hong Kong Inquiry

13214-53-4 / 2-oxoimidazolidine-1-carbonyl chloride

Standard CAS: 13214-53-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
13214-53-4
Multi CAS
No
Molecular Formula
C4H5ClN2O2
Molecular Weight
148.550000
Exact Mass
148.003955
SMILES
C1CN(C(=O)N1)C(=O)Cl
InChI
InChI=1S/C4H5ClN2O2/c5-3(8)7-2-1-6-4(7)9/h1-2H2,(H,6,9)
InChIKey
NXJZQSRAFBHNLI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.5
H-bond acceptors
2
H-bond donors
1
Molar refractivity
31.35
TPSA
49.41

LogP / Solubility

WLOGP
0.37
MLOGP
0.32
XLogP3
0.2
Consensus LogP
0.3
Log S (ESOL)
-0.99
Class (ESOL)
Very soluble
Log S (Ali)
-1.05
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.93
Class (SILICOS-IT)
Very 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)
-3.36

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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