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5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine structure
Fine Chemical

5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine

TL;DR: 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine (CAS 1214977-56-6) is a chemical compound with molecular formula C14H22ClNOS and molecular weight 287.11105 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-(chloromethyl)-N-(2,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine

Also Known As: 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine, [5-(chloromethyl)-1,3-oxathiolan-2-ylidene]-(2,3,3-trimethylnorbornan-2-yl)amine, (1S,2S,4R)-N-(5-(chloromethyl)-1,3-oxathiolan-2-ylidene)-2,3,3-trimethylbicyclo[2.2.1]heptan-2-amine, N-[(2Z)-5-(chloromethyl)-1,3-oxathiolan-2-ylidene]-2,3,3-trimethylbicyclo[2.2.1]heptan-2-amine, N-[5-(chloromethyl)-1,3-oxathiolan-2-ylidene]-2,3,3-trimethylbicyclo[2.2.1]heptan-2-amine

CAS Number
1214977-56-6
Molecular Formula
C14H22ClNOS
Molecular Weight
287.11105 g/mol
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Technical Specifications

Molecular FormulaC14H22ClNOS
Molecular Weight287.11105 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)46.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass287.11105 Da
Heavy Atoms18
Complexity384.0
SMILESCC1(C2CCC(C2)C1(C)N=C3OC(CS3)CCl)C
InChIKeyWOZMOUDIKWPRNW-UHFFFAOYSA-N

Chemical Property Profile of 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine

XLogP
4.3
TPSA (Topological Polar Surface Area)
46.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
18
Complexity
384.0
Exact Mass
287.11105
Monoisotopic Mass
287.11105
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 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine

The XLogP value of 4.3 indicates that 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.9 Ų, 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine?

The CAS number of 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine is 1214977-56-6.

What is the molecular formula of 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine?

The molecular formula of 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine is C14H22ClNOS.

What is the molecular weight of 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine?

The molecular weight of 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine is 287.11105 g/mol.

Where can I buy 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine?

You can request a quote for 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine?

Yes, CoreyChem provides custom synthesis services for 5-(chloromethyl)-N-(2,2,3-trimethyl-3-bicyclo[2.2.1]heptanyl)-1,3-oxathiolan-2-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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