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CAS 22236-11-9 N-[4-(Difluoromethoxy)phenyl]acetamide molecular structure lightbox
CAS RN: 22236-11-9

N-[4-(Difluoromethoxy)phenyl]acetamide

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250121 1g In stock Shanghai Inquiry
Batchno.20250923 250mg In stock Shanghai Inquiry
Batchno.20251204 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong Inquiry
Batchno.20251214 25g In stock Shanghai Inquiry
Batchno.20250302 5g In stock Shanghai, Wuhan Inquiry
  • Product code: SSC-107063
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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 22236-11-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

22236-11-9 / N-[4-(difluoromethoxy)phenyl]acetamide

Standard CAS: 22236-11-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22236-11-9
Multi CAS
No
Molecular Formula
C9H9F2NO2
Molecular Weight
201.170000
Exact Mass
201.060135
SMILES
CC(=O)NC1=CC=C(C=C1)OC(F)F
InChI
InChI=1S/C9H9F2NO2/c1-6(13)12-7-2-4-8(5-3-7)14-9(10)11/h2-5,9H,1H3,(H,12,13)
InChIKey
YZAFOMJODXAJQD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
47.38
TPSA
38.33

LogP / Solubility

WLOGP
2.25
MLOGP
1.98
XLogP3
2
Consensus LogP
2.08
Log S (ESOL)
-2.62
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.83
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.19
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.35

Drug-likeness / Medicinal Chemistry

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

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