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2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine structure
Fine Chemical

2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine

TL;DR: 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine (CAS 100098-85-9) is a chemical compound with molecular formula C15H18ClNO and molecular weight 263.1077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[2-(3-chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine

Also Known As: BW 813U

CAS Number
100098-85-9
Molecular Formula
C15H18ClNO
Molecular Weight
263.1077 g/mol
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Technical Specifications

Molecular FormulaC15H18ClNO
Molecular Weight263.1077 g/mol
XLogP3.9
Topological Polar Surface Area (TPSA)21.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass263.1077 Da
Heavy Atoms18
Complexity348.0
SMILESCC1CC(N=C(O1)C=CC2=CC(=CC=C2)Cl)(C)C
InChIKeyJMSUSBPUYOSDSM-UHFFFAOYSA-N

Chemical Property Profile of 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine

XLogP
3.9
TPSA (Topological Polar Surface Area)
21.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
18
Complexity
348.0
Exact Mass
263.1077
Monoisotopic Mass
263.1077
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-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine

The XLogP value of 3.9 indicates that 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.6 Ų, 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine has 0 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-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?

The CAS number of 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is 100098-85-9.

What is the molecular formula of 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?

The molecular formula of 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is C15H18ClNO.

What is the molecular weight of 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?

The molecular weight of 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is 263.1077 g/mol.

Where can I buy 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?

You can request a quote for 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?

Yes, CoreyChem provides custom synthesis services for 2-[2-(3-Chlorophenyl)ethenyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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