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2-Phenyldodecane structure
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2-Phenyldodecane

TL;DR: 2-Phenyldodecane (CAS 2719-61-1) is a chemical compound with molecular formula C18H30 and molecular weight 246.23476 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

dodecan-2-ylbenzene

Also Known As: 2-PHENYLDODECANE, dodecan-2-ylbenzene, Benzene, (1-methylundecyl)-, Dodecane, 2-phenyl-, (Dodecan-2-yl)benzene

CAS Number
2719-61-1
Molecular Formula
C18H30
Molecular Weight
246.23476 g/mol
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Application Areas

Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Catalysts (5 patents) Dyes & Pigments (2 patents) Heterocyclic Building Blocks (2 patents) Lubricants & Additives (2 patents)

Technical Specifications

Molecular FormulaC18H30
Molecular Weight246.23476 g/mol
XLogP7.9
Topological Polar Surface Area (TPSA)0.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors0
Rotatable Bonds10
Exact Mass246.23476 Da
Heavy Atoms18
Complexity167.0
Vapor Pressure0.000584 [mmHg]
SMILESCCCCCCCCCCC(C)C1=CC=CC=C1
InChIKeyVRPRIAVYSREHAN-UHFFFAOYSA-N

Chemical Property Profile of 2-Phenyldodecane

XLogP
7.9
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
Rotatable Bonds
10
Heavy Atoms
18
Complexity
167.0
Exact Mass
246.23476
Monoisotopic Mass
246.23476
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-Phenyldodecane

The XLogP value of 7.9 indicates that 2-Phenyldodecane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Phenyldodecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyldodecane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 2-Phenyldodecane?

The CAS number of 2-Phenyldodecane is 2719-61-1.

What is the molecular formula of 2-Phenyldodecane?

The molecular formula of 2-Phenyldodecane is C18H30.

What is the molecular weight of 2-Phenyldodecane?

The molecular weight of 2-Phenyldodecane is 246.23476 g/mol.

Where can I buy 2-Phenyldodecane?

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

Does CoreyChem offer custom synthesis for 2-Phenyldodecane?

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

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