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1-(3,4-Dichlorophenyl)cyclopropanecarboxylic Acid

1-(3,4-Dichlorophenyl)cyclopropanecarboxylic Acid - CAS 342386-78-1

Catalog:	BB022021
Product Name:	1-(3,4-Dichlorophenyl)cyclopropanecarboxylic Acid
CAS:	342386-78-1
Synonyms:	1-(3,4-dichlorophenyl)-1-cyclopropanecarboxylic acid; 1-(3,4-dichlorophenyl)cyclopropane-1-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	1-(3,4-dichlorophenyl)cyclopropane-1-carboxylic acid
Description:	1-(3,4-Dichlorophenyl)cyclopropanecarboxylic Acid (CAS# 342386-78-1 ) is a useful research chemical.
Molecular Weight:	231.08
Molecular Formula:	C10H8Cl2O2
Canonical SMILES:	C1CC1(C2=CC(=C(C=C2)Cl)Cl)C(=O)O
InChI:	InChI=1S/C10H8Cl2O2/c11-7-2-1-6(5-8(7)12)10(3-4-10)9(13)14/h1-2,5H,3-4H2,(H,13,14)
InChI Key:	VNBCEUVYNYCYBW-UHFFFAOYSA-N
LogP:	3.10960

Publication Number	Title	Priority Date
AU-2017256172-A1	Modulators of cystic fibrosis transmembrane conductance regulator protein	20160426
CA-3016303-A1	Modulators of cystic fibrosis transmembrane conductance regulator protein	20160426
CN-109219602-A	The regulator of CF transmembrane conductance instrumentality albumen	20160426
EP-3448842-A1	Modulators of cystic fibrosis transmembrane conductance regulator protein	20160426
JP-2019514840-A	Modulator of cystic fibrosis transmembrane conductance regulator protein	20160426

PMID	Publication Date	Title	Journal
21834094	20111004	Optimisation of the anti-Trypanosoma brucei activity of the opioid agonist U50488	ChemMedChem

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

Complexity:	251
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	229.9901349
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	229.9901349
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3