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CAS 51599-68-9 Pyrrolidine, 1-(methylsulfonyl)- (9CI) molecular structure lightbox
CAS RN: 51599-68-9

Pyrrolidine, 1-(methylsulfonyl)- (9CI)

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250810 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-158526
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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 51599-68-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

51599-68-9 / 1-methylsulfonylpyrrolidine

Standard CAS: 51599-68-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
51599-68-9
Multi CAS
No
Molecular Formula
C5H11NO2S
Molecular Weight
149.210000
Exact Mass
149.051050
InChI
InChI=1S/C5H11NO2S/c1-9(7,8)6-4-2-3-5-6/h2-5H2,1H3
InChIKey
GMQPIGJXSZAXSJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
35.65
TPSA
37.38

LogP / Solubility

WLOGP
0.04
MLOGP
0.03
Consensus LogP
0.02
Log S (ESOL)
-0.73
Class (ESOL)
Very soluble
Log S (Ali)
-0.81
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.78
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)
-3.6

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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