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2-Allyliminotetrahydrothiazole structure
Fine Chemical

2-Allyliminotetrahydrothiazole

TL;DR: 2-Allyliminotetrahydrothiazole (CAS 13578-59-1) is a chemical compound with molecular formula C6H10N2S and molecular weight 142.05647 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine

Also Known As: 2-allyliminothiazolidine, 2-Allyliminotetrahydrothiazole, allyl-(4,5-dihydro-thiazol-2-yl)-amine, N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine, N-[(2Z)-1,3-Thiazolidin-2-ylidene]-2-propen-1-amine #

CAS Number
13578-59-1
Molecular Formula
C6H10N2S
Molecular Weight
142.05647 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (3 patents) Heterocyclic Building Blocks (5 patents)

Technical Specifications

Molecular FormulaC6H10N2S
Molecular Weight142.05647 g/mol
XLogP0.8
Topological Polar Surface Area (TPSA)49.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass142.05647 Da
Heavy Atoms9
Complexity131.0
SMILESC=CCNC1=NCCS1
InChIKeyRDBNJKNWWYRKGA-UHFFFAOYSA-N

Chemical Property Profile of 2-Allyliminotetrahydrothiazole

XLogP
0.8
TPSA (Topological Polar Surface Area)
49.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
9
Complexity
131.0
Exact Mass
142.05647
Monoisotopic Mass
142.05647
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-Allyliminotetrahydrothiazole

The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Allyliminotetrahydrothiazole. With a topological polar surface area (TPSA) of 49.7 Ų, 2-Allyliminotetrahydrothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Allyliminotetrahydrothiazole has 1 hydrogen bond donor(s) and 2 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-Allyliminotetrahydrothiazole?

The CAS number of 2-Allyliminotetrahydrothiazole is 13578-59-1.

What is the molecular formula of 2-Allyliminotetrahydrothiazole?

The molecular formula of 2-Allyliminotetrahydrothiazole is C6H10N2S.

What is the molecular weight of 2-Allyliminotetrahydrothiazole?

The molecular weight of 2-Allyliminotetrahydrothiazole is 142.05647 g/mol.

Where can I buy 2-Allyliminotetrahydrothiazole?

You can request a quote for 2-Allyliminotetrahydrothiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-Allyliminotetrahydrothiazole?

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

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