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CAS 2351-74-8 Methane, chloro(Methylsulfonyl)- molecular structure lightbox
CAS RN: 2351-74-8

Methane, chloro(Methylsulfonyl)-

  • Product code: SSC-113707
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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: 0.25g
  • 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 2351-74-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry

2351-74-8 / chloro(methylsulfonyl)methane

Standard CAS: 2351-74-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2351-74-8
Multi CAS
No
Molecular Formula
C2H5ClO2S
Molecular Weight
128.580000
Exact Mass
127.969878
SMILES
CS(=O)(=O)CCl
InChI
InChI=1S/C2H5ClO2S/c1-6(4,5)2-3/h2H2,1H3
InChIKey
MZMGJAFJUYKKLI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
25.56
TPSA
34.14

LogP / Solubility

WLOGP
0.23
MLOGP
0.19
XLogP3
0.3
Consensus LogP
0.24
Log S (ESOL)
-0.71
Class (ESOL)
Very soluble
Log S (Ali)
-0.78
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.8
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)
-3.34

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

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