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CAS 1009-06-9 N-(2-Bromo-5-fluorophenyl)acetamide molecular structure lightbox
CAS RN: 1009-06-9

N-(2-Bromo-5-fluorophenyl)acetamide

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250125 5g / 25g / 100g Out of stock 5-7 business days Inquiry
  • Product code: SSC-001632
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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: 25g
  • 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 1009-06-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Shenzhen Inquiry

1009-06-9 / N-(2-bromo-5-fluorophenyl)acetamide

N-(2-Bromo-5-fluorophenyl)acetamide | MFCD09753710 | SCHEMBL375020

Standard CAS: 1009-06-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1009-06-9
Multi CAS
No
Molecular Formula
C8H7BrFNO
Molecular Weight
232.050000
Exact Mass
230.969500
SMILES
CC(=O)NC1=C(C=CC(=C1)F)Br
InChI
InChI=1S/C8H7BrFNO/c1-5(12)11-8-4-6(10)2-3-7(8)9/h2-4H,1H3,(H,11,12)
InChIKey
ZONOJQNMZGORON-UHFFFAOYSA-N
Synonyms
N-(2-Bromo-5-fluorophenyl)acetamide MFCD09753710 SCHEMBL375020 SCHEMBL30005976 N-(2-bromo-5-fluoro-phenyl)acetamide

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.4
TPSA
29.1

LogP / Solubility

WLOGP
2.55
MLOGP
2.24
XLogP3
1.7
Consensus LogP
2.16
Log S (ESOL)
-3.19
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.4
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)
-2.33

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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