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1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone structure
Fine Chemical

1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone

TL;DR: 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone (CAS 1213782-23-0) is a chemical compound with molecular formula C13H15NO and molecular weight 201.11537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(10-azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone

Also Known As: ethanone, 1-(1,2,4,5-tetrahydro-1,5-methano-3h-3-benzazepin-3-yl)-

CAS Number
1213782-23-0
Molecular Formula
C13H15NO
Molecular Weight
201.11537 g/mol
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Technical Specifications

Molecular FormulaC13H15NO
Molecular Weight201.11537 g/mol
XLogP1.4
Topological Polar Surface Area (TPSA)20.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds0
Exact Mass201.11537 Da
Heavy Atoms15
Complexity256.0
SMILESCC(=O)N1CC2CC(C1)C3=CC=CC=C23
InChIKeyIEOXWKKEWRMDDQ-UHFFFAOYSA-N

Chemical Property Profile of 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone

XLogP
1.4
TPSA (Topological Polar Surface Area)
20.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Heavy Atoms
15
Complexity
256.0
Exact Mass
201.11537
Monoisotopic Mass
201.11537
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-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone

The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone 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 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone?

The CAS number of 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone is 1213782-23-0.

What is the molecular formula of 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone?

The molecular formula of 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone is C13H15NO.

What is the molecular weight of 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone?

The molecular weight of 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone is 201.11537 g/mol.

Where can I buy 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone?

You can request a quote for 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone?

Yes, CoreyChem provides custom synthesis services for 1-(10-Azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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