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1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- structure
Fine Chemical

1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-

TL;DR: 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- (CAS 103660-35-1) is a chemical compound with molecular formula C14H14ClNO and molecular weight 247.07639 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2Z)-2-[(2-chlorophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-one

Also Known As: BAS 00874012, (2Z)-2-[(2-chlorophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-one, 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-, 2-(2-Chloro-benzylidene)-1-aza-bicyclo[2.2.2]octan-3-one, (2Z)-2-(2-chlorobenzylidene)-1-azabicyclo[2.2.2]octan-3-one

CAS Number
103660-35-1
Molecular Formula
C14H14ClNO
Molecular Weight
247.07639 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (5 patents) Organometallic Reagents (2 patents) Pharmaceutical Intermediates (5 patents)

Technical Specifications

Molecular FormulaC14H14ClNO
Molecular Weight247.07639 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)20.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass247.07639 Da
Heavy Atoms17
Complexity344.0
SMILESC1CN\2CCC1C(=O)/C2=C/C3=CC=CC=C3Cl
InChIKeyWNICXJVIQXXISD-LCYFTJDESA-N

Chemical Property Profile of 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-

XLogP
3.3
TPSA (Topological Polar Surface Area)
20.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
17
Complexity
344.0
Exact Mass
247.07639
Monoisotopic Mass
247.07639
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 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-

The XLogP value of 3.3 indicates that 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- 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 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-?

The CAS number of 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- is 103660-35-1.

What is the molecular formula of 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-?

The molecular formula of 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- is C14H14ClNO.

What is the molecular weight of 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-?

The molecular weight of 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- is 247.07639 g/mol.

Where can I buy 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-?

You can request a quote for 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)-?

Yes, CoreyChem provides custom synthesis services for 1-Azabicyclo[2.2.2]octan-3-one, 2-[(2-chlorophenyl)methylene]-, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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