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CAS 1171938-74-1 5-(2-Fluoro-5-nitrophenyl)-2H-tetrazole molecular structure lightbox
CAS RN: 1171938-74-1

5-(2-Fluoro-5-nitrophenyl)-2H-tetrazole

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260605 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: SSC-017068
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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, 0.1g, 0.25g
  • Available purity: >97%
  • Inventory rows with stock: 3
  • 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 1171938-74-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Shanghai Inquiry
5g >97% 2 In Stock Shenzhen Inquiry
0.1g >97% 1 In Stock Shenzhen Inquiry
0.25g >97% 0 Out of Stock Shenzhen Inquiry

1171938-74-1 / 5-(2-fluoro-5-nitrophenyl)-2H-tetrazole

5-(2-Fluoro-5-nitrophenyl)-2H-tetrazole | MFCD18375288 | 2H-Tetrazole, 5-(2-fluoro-5-nitrophenyl)-

Standard CAS: 1171938-74-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1171938-74-1
Multi CAS
Yes
Molecular Formula
C7H4FN5O2
Molecular Weight
209.140000
Exact Mass
209.034903
SMILES
C1=CC(=C(C=C1[N+](=O)[O-])C2=NNN=N2)F
InChI
InChI=1S/C7H4FN5O2/c8-6-2-1-4(13(14)15)3-5(6)7-9-11-12-10-7/h1-3H,(H,9,10,11,12)
InChIKey
FPUYMBWDUWZGHY-UHFFFAOYSA-N
Synonyms
5-(2-Fluoro-5-nitrophenyl)-2H-tetrazole MFCD18375288 2H-Tetrazole, 5-(2-fluoro-5-nitrophenyl)- AKOS025404303 AS-32482

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
11
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
46.23
TPSA
97.6

LogP / Solubility

WLOGP
0.91
MLOGP
0.81
XLogP3
1.1
Consensus LogP
0.94
Log S (ESOL)
-2.12
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.93
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.02
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.35

Drug-likeness / Medicinal Chemistry

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

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