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CAS 78303-71-6 2-(chlorosulfonyl)ethyl acetate molecular structure lightbox
CAS RN: 78303-71-6

2-(chlorosulfonyl)ethyl acetate

  • Product code: SSC-187751
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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 78303-71-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

78303-71-6 / 2-chlorosulfonylethyl acetate

Standard CAS: 78303-71-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
78303-71-6
Multi CAS
No
Molecular Formula
C4H7CLO4S
Molecular Weight
186.610000
Exact Mass
185.975358
InChI
InChI=1S/C4H7ClO4S/c1-4(6)9-2-3-10(5,7)8/h2-3H2,1H3
InChIKey
MUWVJHSRIWOIJE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.75
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
36.27
TPSA
60.44

LogP / Solubility

WLOGP
0.12
MLOGP
0.1
XLogP3
0.3
Consensus LogP
0.17
Log S (ESOL)
-0.87
Class (ESOL)
Very soluble
Log S (Ali)
-1.18
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.33
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)
-3.77

Drug-likeness / Medicinal Chemistry

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

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