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CAS 314298-13-0 Benzene, 1-fluoro-5-methoxy-2-methyl-4-nitro- (9CI) molecular structure lightbox
CAS RN: 314298-13-0

Benzene, 1-fluoro-5-methoxy-2-methyl-4-nitro- (9CI)

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250206 100mg In stock Inquiry
Batchno.20250124 1g In stock Inquiry
Batchno.20260218 250mg In stock Inquiry
Batchno.20251007 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250727 250mg / 1g / 100g Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: SSC-136814
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 0.25g, 0.1g, 5g, 10g, 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 314298-13-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Shenzhen Inquiry
0.25g ≥97% 1 In Stock Beijing Inquiry
0.1g ≥97% 0 Out of Stock Shanghai Inquiry
5g ≥97% 0 Out of Stock Hong Kong Inquiry
10g ≥97% 0 Out of Stock Hong Kong Inquiry
25g ≥97% 0 Out of Stock Hong Kong Inquiry

314298-13-0 / 1-fluoro-5-methoxy-2-methyl-4-nitrobenzene

Standard CAS: 314298-13-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
314298-13-0
Multi CAS
No
Molecular Formula
C8FH8NO3
Molecular Weight
185.150000
Exact Mass
185.048821
InChI
InChI=1S/C8H8FNO3/c1-5-3-7(10(11)12)8(13-2)4-6(5)9/h3-4H,1-2H3
InChIKey
JQNHPTUQNTUAJC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
44.34
TPSA
52.37

LogP / Solubility

WLOGP
2.05
MLOGP
1.8
XLogP3
2.2
Consensus LogP
2.02
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.56
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.81
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)
-2.39

Drug-likeness / Medicinal Chemistry

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

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