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2-Amino-1,3,4-oxadiazole structure
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2-Amino-1,3,4-oxadiazole

TL;DR: 2-Amino-1,3,4-oxadiazole (CAS 1227590-99-9) is a chemical compound with molecular formula C2H3N3O and molecular weight 85.02761 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,3,4-oxadiazol-2-amine

Also Known As: 1,3,4-oxadiazol-2-amine, 2-amino-1,3,4-oxadiazole, [1,3,4]oxadiazol-2-ylamine, 1,3,4-Oxadiazole-2-amine, 1,3,4-oxadiazol-2-ylamine

CAS Number
1227590-99-9
Molecular Formula
C2H3N3O
Molecular Weight
85.02761 g/mol
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Application Areas

Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (20 patents) Biotechnology (1 patents) Catalysts (2 patents) Dyes & Pigments (9 patents) Heterocyclic Building Blocks (270 patents)

Technical Specifications

Molecular FormulaC2H3N3O
Molecular Weight85.02761 g/mol
XLogP-1.4
Topological Polar Surface Area (TPSA)64.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds0
Exact Mass85.02761 Da
Heavy Atoms6
Complexity48.0
SMILESC1=NN=C(O1)N
InChIKeyAPKZPKINPXTSNL-UHFFFAOYSA-N

Chemical Property Profile of 2-Amino-1,3,4-oxadiazole

XLogP
-1.4
TPSA (Topological Polar Surface Area)
64.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
0
Heavy Atoms
6
Complexity
48.0
Exact Mass
85.02761
Monoisotopic Mass
85.02761
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-Amino-1,3,4-oxadiazole

The XLogP value of -1.4 indicates that 2-Amino-1,3,4-oxadiazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-1,3,4-oxadiazole. Following Lipinski's Rule of Five, 2-Amino-1,3,4-oxadiazole has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-Amino-1,3,4-oxadiazole?

The CAS number of 2-Amino-1,3,4-oxadiazole is 1227590-99-9.

What is the molecular formula of 2-Amino-1,3,4-oxadiazole?

The molecular formula of 2-Amino-1,3,4-oxadiazole is C2H3N3O.

What is the molecular weight of 2-Amino-1,3,4-oxadiazole?

The molecular weight of 2-Amino-1,3,4-oxadiazole is 85.02761 g/mol.

Where can I buy 2-Amino-1,3,4-oxadiazole?

You can request a quote for 2-Amino-1,3,4-oxadiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-Amino-1,3,4-oxadiazole?

Yes, CoreyChem provides custom synthesis services for 2-Amino-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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