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(E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine structure
Fine Chemical

(E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine

TL;DR: (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine (CAS 1024853-83-5) is a chemical compound with molecular formula C20H25N3O and molecular weight 323.19977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine

Also Known As: (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine, aza(3-(4-(tert-butyl)phenyl)-7-methyl(6,7,8-trihydrocinnolin-5-ylidene))methoxymethane, (5E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-5,6,7,8-tetrahydrocinnolin-5-imine

CAS Number
1024853-83-5
Molecular Formula
C20H25N3O
Molecular Weight
323.19977 g/mol
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Technical Specifications

Molecular FormulaC20H25N3O
Molecular Weight323.19977 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)47.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass323.19977 Da
Heavy Atoms24
Complexity448.0
SMILESCC1CC2=NN=C(C=C2/C(=N/OC)/C1)C3=CC=C(C=C3)C(C)(C)C
InChIKeyYPIJPSLKDLRPHL-FCDQGJHFSA-N

Product Description

Applications: (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

(E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine (CAS 1024853-83-5) is a fine chemical with the molecular formula C20H25N3O and a molecular weight of 323.2 g/mol. Synonyms include MS-9121 and (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine.

Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine

XLogP
4.3
TPSA (Topological Polar Surface Area)
47.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
24
Complexity
448.0
Exact Mass
323.19977
Monoisotopic Mass
323.19977
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 (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine

The XLogP value of 4.3 indicates that (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.4 Ų, (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine?

The CAS number of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine is 1024853-83-5.

What is the molecular formula of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine?

The molecular formula of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine is C20H25N3O.

What is the molecular weight of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine?

The molecular weight of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine is 323.19977 g/mol.

What are the applications of (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine?

(E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale),...

Where can I buy (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine?

You can request a quote for (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine?

Yes, CoreyChem provides custom synthesis services for (E)-3-(4-tert-butylphenyl)-N-methoxy-7-methyl-7,8-dihydro-6H-cinnolin-5-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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