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CAS 2689-39-6 4-(2-FLUORO-4-NITRO-PHENYL)-MORPHOLINE molecular structure lightbox
CAS RN: 2689-39-6

4-(2-FLUORO-4-NITRO-PHENYL)-MORPHOLINE

Product Availability

Choose a grade to view its available package options.

10 package records10 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260315 100g In stock Inquiry
Batchno.20250822 1g In stock Inquiry
Batchno.20251019 25g In stock Inquiry
Batchno.20251128 500g In stock Inquiry
Batchno.20260629 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250216 100g In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20260626 25g In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20250306 500g In stock Shanghai Inquiry
Batchno.20250919 5g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20250106 5g / 25g / 100g / 500g Confirm by inquiry Shandong, Shanghai Inquiry
  • Product code: SSC-125284
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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: ≥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 2689-39-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

2689-39-6 / 4-(2-fluoro-4-nitrophenyl)morpholine

Standard CAS: 2689-39-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2689-39-6
Multi CAS
No
Molecular Formula
C10H11FN2O3
Molecular Weight
226.200000
Exact Mass
226.075370
SMILES
C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])F
InChI
InChI=1S/C10H11FN2O3/c11-9-7-8(13(14)15)1-2-10(9)12-3-5-16-6-4-12/h1-2,7H,3-6H2
InChIKey
ZEQCFSSBZPZEFJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
56.09
TPSA
55.61

LogP / Solubility

WLOGP
1.57
MLOGP
1.39
XLogP3
1.6
Consensus LogP
1.52
Log S (ESOL)
-2.38
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.55
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.67
Class (SILICOS-IT)
Moderately 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)
-2.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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