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Benzene, [(3-phenyl-2-propenyl)thio]- structure
Fine Chemical

Benzene, [(3-phenyl-2-propenyl)thio]-

TL;DR: Benzene, [(3-phenyl-2-propenyl)thio]- (CAS 10276-14-9) is a chemical compound with molecular formula C15H14S and molecular weight 226.08162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[(E)-3-phenylprop-2-enyl]sulfanylbenzene

Also Known As: phenylcinnamyl sulfide, Cinnamylphenyl sulfide, 3-Phenylallylphenyl sulfide, Phenyl(3-phenylallyl)sulfane, trans-cinnamyl phenyl sulfide

CAS Number
10276-14-9
Molecular Formula
C15H14S
Molecular Weight
226.08162 g/mol
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Technical Specifications

Molecular FormulaC15H14S
Molecular Weight226.08162 g/mol
XLogP4.6
Topological Polar Surface Area (TPSA)25.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds4
Exact Mass226.08162 Da
Heavy Atoms16
Complexity197.0
SMILESC1=CC=C(C=C1)/C=C/CSC2=CC=CC=C2
InChIKeyFEHPZIJSLMHZSJ-JXMROGBWSA-N

Chemical Property Profile of Benzene, [(3-phenyl-2-propenyl)thio]-

XLogP
4.6
TPSA (Topological Polar Surface Area)
25.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
4
Heavy Atoms
16
Complexity
197.0
Exact Mass
226.08162
Monoisotopic Mass
226.08162
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 Benzene, [(3-phenyl-2-propenyl)thio]-

The XLogP value of 4.6 indicates that Benzene, [(3-phenyl-2-propenyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Benzene, [(3-phenyl-2-propenyl)thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, [(3-phenyl-2-propenyl)thio]- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Benzene, [(3-phenyl-2-propenyl)thio]-?

The CAS number of Benzene, [(3-phenyl-2-propenyl)thio]- is 10276-14-9.

What is the molecular formula of Benzene, [(3-phenyl-2-propenyl)thio]-?

The molecular formula of Benzene, [(3-phenyl-2-propenyl)thio]- is C15H14S.

What is the molecular weight of Benzene, [(3-phenyl-2-propenyl)thio]-?

The molecular weight of Benzene, [(3-phenyl-2-propenyl)thio]- is 226.08162 g/mol.

Where can I buy Benzene, [(3-phenyl-2-propenyl)thio]-?

You can request a quote for Benzene, [(3-phenyl-2-propenyl)thio]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Benzene, [(3-phenyl-2-propenyl)thio]-?

Yes, CoreyChem provides custom synthesis services for Benzene, [(3-phenyl-2-propenyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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