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CAS 30334-69-1 1,1,2,2,3,3,4,4,4-Nonafluoro-butane-1-sulfonic acid amide molecular structure lightbox
CAS RN: 30334-69-1

1,1,2,2,3,3,4,4,4-Nonafluoro-butane-1-sulfonic acid amide

  • Product code: SSC-134532
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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: ＞97%
  • 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 30334-69-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

30334-69-1 / 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonamide

Standard CAS: 30334-69-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
30334-69-1
Multi CAS
No
Molecular Formula
C4F9H2NO2S
Molecular Weight
299.120000
Exact Mass
298.966253
InChI
InChI=1S/C4H2F9NO2S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H2,14,15,16)
InChIKey
FUVKFLJWBHVMHX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
34
TPSA
60.16

LogP / Solubility

WLOGP
1.7
MLOGP
1.51
XLogP3
2.2
Consensus LogP
1.8
Log S (ESOL)
-2.57
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.24
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.38
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
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
Yes
Synthetic Accessibility
1.5

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