Name: Name:1-(3-chloropropyl)imidazole
Brand: AABLOCKS
SKU: AA00DJGA
Rating: 90 (10 reviews)

Catalog No.: AA00DJGA

53710-78-4 | 1-(3-chloropropyl)imidazole

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Technical Information

Catalog Number: AA00DJGA

Chemical Name: 1-(3-chloropropyl)imidazole

CAS Number: 53710-78-4

Molecular Formula: C6H9ClN2

Molecular Weight: 144.6021

MDL Number: MFCD09728547

SMILES: ClCCCn1cncc1

Properties

Complexity: 77.5

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 9

Hydrogen Bond Acceptor Count: 1

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 3

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 0.9

Upstream Synthesis Route

288-32-4

109-70-6

53710-78-4

[1]TetrahedronLetters,2010,vol.51,#28,p.3666-3669

[2]Patent:WO2014/12360,2014,A1,.Locationinpatent:Paragraph00398

[3]Patent:US2015/87639,2015,A1,.Locationinpatent:Paragraph0703

[4]Patent:TWI607995,2017,B,.Locationinpatent:Page/Pagecolumn154

[5]EuropeanJournalofOrganicChemistry,2009,#19,p.3249-3257

[6]Patent:US2004/54186,2004,A1,.Locationinpatent:Page145

[7]EuropeanJournalofMedicinalChemistry,2016,vol.109,p.75-88

[8]Patent:CN105439908,2016,A,.Locationinpatent:Paragraph0013;0014

Downstream Synthesis Route

53710-78-4

10597-52-1

302964-15-4

[1]Patent:US2004/54186,2004,A1.Locationinpatent:Page145

53710-78-4

879-37-8

1178894-76-2

[1]BioorganicandMedicinalChemistry,2009,vol.17,p.4302-4312

53710-78-4

18372-22-0

1443138-38-2

[1]Molecules,2013,vol.18,p.5498-5516

[2]ArchivderPharmazie,2013,vol.346,p.349-358

[3]Patent:CN104693198,2017,B.Locationinpatent:Paragraph0080;0081

[4]ArchivderPharmazie,2018,vol.351

53710-78-4

369-35-7

220159-01-3

[1]Patent:WO2014/12360,2014,A1.Locationinpatent:Paragraph00400

[2]Patent:US2015/87639,2015,A1.Locationinpatent:Paragraph0704

[3]Patent:TWI607995,2017,B.Locationinpatent:Page/Pagecolumn154;155

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