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CAS 1943-83-5 2-Chloroethyl Isocyanate molecular structure lightbox
CAS RN: 1943-83-5

2-Chloroethyl Isocyanate

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260517 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-091719
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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, 25g, 100g, 500g
  • Available purity: >98%
  • Inventory rows with stock: 4
  • 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 1943-83-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >98% 2 In Stock Beijing Inquiry
10g >98% 1 In Stock Hong Kong Inquiry
25g >98% 1 In Stock Shanghai Inquiry
100g >98% 1 In Stock Beijing Inquiry
500g >98% 0 Out of Stock Shanghai Inquiry

1943-83-5 / 1-chloro-2-isocyanatoethane

Standard CAS: 1943-83-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1943-83-5
Multi CAS
No
Molecular Formula
C3H4ClNO
Molecular Weight
105.520000
Exact Mass
104.998141
SMILES
C(CCl)N=C=O
InChI
InChI=1S/C3H4ClNO/c4-1-2-5-3-6/h1-2H2
InChIKey
BCMYXYHEMGPZJN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
23.71
TPSA
29.43

LogP / Solubility

WLOGP
0.56
MLOGP
0.48
XLogP3
1.6
Consensus LogP
0.88
Log S (ESOL)
-0.72
Class (ESOL)
Very soluble
Log S (Ali)
-0.83
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.05
Class (SILICOS-IT)
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)
-2.97

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)
Flammable Acute Toxic Irritant Health Hazard
Signal
Danger
GHS Hazard Statements
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] H301+H331 (73.6%): Toxic if swallowed or if inhaled [Danger Acute toxicity, oral; acute toxicity, inhalation] H301 (92.5%): Toxic if swallowed [Danger Acute toxicity, oral] H315 (90.6%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (90.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P370+P378, P403, P403+P233, P403+P235, P405, and P501

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