2-Chloro-4-(1-imidazolyl)benzaldehyde - CAS 1141669-45-5

Catalog:	BB003305
Product Name:	2-Chloro-4-(1-imidazolyl)benzaldehyde
CAS:	1141669-45-5
Synonyms:	2-chloro-4-(1-imidazolyl)benzaldehyde; 2-chloro-4-imidazol-1-ylbenzaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	2-chloro-4-imidazol-1-ylbenzaldehyde
Description:	2-Chloro-4-(1-imidazolyl)benzaldehyde (CAS# 1141669-45-5) is a useful research chemical.
Molecular Weight:	206.63
Molecular Formula:	C10H7ClN2O
Canonical SMILES:	C1=CC(=C(C=C1N2C=CN=C2)Cl)C=O
InChI:	InChI=1S/C10H7ClN2O/c11-10-5-9(2-1-8(10)6-14)13-4-3-12-7-13/h1-7H
InChI Key:	BUUCGRMFXGLDNV-UHFFFAOYSA-N
LogP:	2.33820

Publication Number	Title	Priority Date
WO-2021203016-A2	Protein-protein interaction stabilizers	20200403
CN-112608320-A	Piperidine compound and preparation method and medical application thereof	20200116
WO-2021143792-A1	Piperidine compound, preparation method therefor and medical use thereof	20200116
AU-2007283819-A1	Insecticidal isoxazolines	20060815
AU-2007283819-B2	Insecticidal isoxazolines	20060815

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Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	206.0246905
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	206.0246905
Rotatable Bond Count:	2
Topological Polar Surface Area:	34.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8