5-chloro-2-ethyl-1H-imidazole-4-carbaldehyde - CAS 145824-12-0

Catalog:	BB010012
Product Name:	5-chloro-2-ethyl-1H-imidazole-4-carbaldehyde
CAS:	145824-12-0
Synonyms:	5-chloro-2-ethyl-1H-imidazole-4-carboxaldehyde; 5-chloro-2-ethyl-1H-imidazole-4-carbaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	5-chloro-2-ethyl-1H-imidazole-4-carbaldehyde
Description:	5-chloro-2-ethyl-1H-imidazole-4-carbaldehyde (CAS# 145824-12-0 ) is a useful research chemical.
Molecular Weight:	158.585
Molecular Formula:	C6H7ClN2O
Canonical SMILES:	CCC1=NC(=C(N1)Cl)C=O
InChI:	InChI=1S/C6H7ClN2O/c1-2-5-8-4(3-10)6(7)9-5/h3H,2H2,1H3,(H,8,9)
InChI Key:	RCARQCCTRSJKNE-UHFFFAOYSA-N
MDL:	MFCD09258815
LogP:	1.43800

Publication Number	Title	Priority Date
EP-2558577-A1	Bi-functional complexes and methods for making and using such complexes	20100416
US-2013281324-A1	Bi-functinal complexes and methods for making and using such complexes	20100416
WO-2011127933-A1	Bi-functional complexes and methods for making and using such complexes	20100416
AU-2008261977-A1	Chemical compounds	20070606
CA-2694871-A1	Chemical compounds	20070606

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Complexity:	131
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	158.0246905
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	158.0246905
Rotatable Bond Count:	2
Topological Polar Surface Area:	45.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7