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Undec-10-en-1-yl carbamimidothioate structure
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Undec-10-en-1-yl carbamimidothioate

TL;DR: Undec-10-en-1-yl carbamimidothioate (CAS 50791-82-7) is a chemical compound with molecular formula C12H24N2S and molecular weight 228.16602 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

undec-10-enyl carbamimidothioate

Also Known As: starbld0038131, 2-(10-Undecenyl)isothiourea, undec-10-enyl carbamimidothioate, Undec-10-en-1-yl carbamimidothioate, (undec-10-en-1-ylsulfanyl)methanimidamide

CAS Number
50791-82-7
Molecular Formula
C12H24N2S
Molecular Weight
228.16602 g/mol
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Technical Specifications

Molecular FormulaC12H24N2S
Molecular Weight228.16602 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)75.2 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds11
Exact Mass228.16602 Da
Heavy Atoms15
Complexity169.0
SMILESC=CCCCCCCCCCSC(=N)N
InChIKeyOEXJBTRYLHGHNY-UHFFFAOYSA-N

Chemical Property Profile of Undec-10-en-1-yl carbamimidothioate

XLogP
4.7
TPSA (Topological Polar Surface Area)
75.2
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
11
Heavy Atoms
15
Complexity
169.0
Exact Mass
228.16602
Monoisotopic Mass
228.16602
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 Undec-10-en-1-yl carbamimidothioate

The XLogP value of 4.7 indicates that Undec-10-en-1-yl carbamimidothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Undec-10-en-1-yl carbamimidothioate. Following Lipinski's Rule of Five, Undec-10-en-1-yl carbamimidothioate has 2 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 Undec-10-en-1-yl carbamimidothioate?

The CAS number of Undec-10-en-1-yl carbamimidothioate is 50791-82-7.

What is the molecular formula of Undec-10-en-1-yl carbamimidothioate?

The molecular formula of Undec-10-en-1-yl carbamimidothioate is C12H24N2S.

What is the molecular weight of Undec-10-en-1-yl carbamimidothioate?

The molecular weight of Undec-10-en-1-yl carbamimidothioate is 228.16602 g/mol.

Where can I buy Undec-10-en-1-yl carbamimidothioate?

You can request a quote for Undec-10-en-1-yl carbamimidothioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Undec-10-en-1-yl carbamimidothioate?

Yes, CoreyChem provides custom synthesis services for Undec-10-en-1-yl carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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