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CAS 1197193-21-7 4-Fluoro-2-(methylsulfonyl)aniline molecular structure lightbox
CAS RN: 1197193-21-7

4-Fluoro-2-(methylsulfonyl)aniline

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260316 1g / 5g / 10g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-020425
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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, 5g, 10g, 0.1g, 0.25g, 25g, 100g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • 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 1197193-21-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Shenzhen Inquiry
5g >97% 4 In Stock Shanghai Inquiry
10g >97% 4 In Stock Shanghai Inquiry
0.1g >97% 2 In Stock Shenzhen Inquiry
0.25g >97% 2 In Stock Beijing Inquiry
25g >97% 2 In Stock Hong Kong Inquiry
100g >97% 0 Out of Stock Shanghai Inquiry

1197193-21-7 / 4-fluoro-2-methylsulfonylaniline

4-FLUORO-2-(METHYLSULFONYL)ANILINE | 4-fluoro-2-methylsulfonylaniline | Benzenamine, 4-fluoro-2-(methylsulfonyl)-

Standard CAS: 1197193-21-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1197193-21-7
Multi CAS
No
Molecular Formula
C7H8FNO2S
Molecular Weight
189.210000
Exact Mass
189.025978
SMILES
CS(=O)(=O)C1=C(C=CC(=C1)F)N
InChI
InChI=1S/C7H8FNO2S/c1-12(10,11)7-4-5(8)2-3-6(7)9/h2-4H,9H2,1H3
InChIKey
LKNIYDMDXQVUQA-UHFFFAOYSA-N
Synonyms
4-FLUORO-2-(METHYLSULFONYL)ANILINE 4-fluoro-2-methylsulfonylaniline Benzenamine, 4-fluoro-2-(methylsulfonyl)- MFCD13191582 4-fluoro-2-methylsulfonyl-aniline

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
43.92
TPSA
60.16

LogP / Solubility

WLOGP
0.81
MLOGP
0.71
XLogP3
1.1
Consensus LogP
0.87
Log S (ESOL)
-1.83
Class (ESOL)
Soluble
Log S (Ali)
-1.7
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.68
Class (SILICOS-IT)
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)
-3.3

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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