3-(2,3-Dichlorobenzoyl)-propionic Acid

CAT: 0572-TRC-D435595-100MGSize: 100 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-D435595-100MGSize:100 mg

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CAS Number

32003-41-1

Synonyms

2,3-Dichloro-gamma-oxo-benzenebutanoic Acid

Hazard Statement

No Data Available

Smiles

OC(=O)CCC(=O)c1cccc(Cl)c1Cl

Molecular Formula

C10H8Cl2O3

Molecular Weight

247.07

Shipping Conditions

Room Temperature

Chemical Information

4-(2,3-Dichlorophenyl)-4-oxobutanoic acid

CAS Number	32003-41-1
PubChem CID	14710988
IUPAC Name	4-(2,3-dichlorophenyl)-4-oxobutanoic acid
Molecular Formula	C10H8Cl2O3
Molecular Weight	247.07
XLogP	2.3
Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	15
Formal Charge	0
Complexity	255

SMILES

C1=CC(=C(C(=C1)Cl)Cl)C(=O)CCC(=O)O

InChI

InChI=1S/C10H8Cl2O3/c11-7-3-1-2-6(10(7)12)8(13)4-5-9(14)15/h1-3H,4-5H2,(H,14,15)

InChIKey

ZDPLPJUODUTOIR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 32003-41-1

CID: 14710988

Formula: C10H8Cl2O3

MW: 247.07

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	247.07
XLogP3	2.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	245.9850495
Monoisotopic Mass	245.9850495
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	255
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
TRC-D432295-2.5G	3-(2,4-Dichlorobenzoyl)propionic Acid
TRC-D452375-1G	3-(2,3-Dihydroxyphenyl)propionic Acid
TRC-H999850-50MG	3-(2-Hydroxyphenyl)propionic Acid
TRC-H999850-100MG	3-(2-Hydroxyphenyl)propionic Acid
TRC-D452375-250MG	3-(2,3-Dihydroxyphenyl)propionic Acid
TRC-A607925-100MG	3-(2-Aminoethoxy)propionic Acid
TRC-H999850-10MG	3-(2-Hydroxyphenyl)propionic Acid
D461075	3-(2,3-Dimethoxyphenyl)propionic Acid
H942130	3-(2-Hydroxyethyldithio)propionic Acid
TRC-D431705-10G	2,3-Dichlorobenzoyl chloride

Alternative Products

Catalog	Name
MBS6050532-01	3-(2,3-Dichlorobenzoyl)-propionic Acid
009225	3- (2,3-Dichlorobenzoyl) -propionic Acid
422533-01	3- (2,4-Dichlorobenzoyl) propionic Acid
009145	2- (3,4-Dichlorobenzoyl) benzoic Acid
MBS6059210-01	2-(3,4-Dichlorobenzoyl)benzoic Acid
sc-280318A	3- (2,3-Dichlorophenyl) propionic acid
sc-225854	3- (2,3-Dimethoxyphenyl) propionic acid
ABA17373-01	3- (2',3'-Dimethylphenyl) propionic acid
sc-498590	3- (2,3-Dihydroxyphenyl) propionic Acid
MRA96126-01	3- (2,3-difluorophenyl) propionic acid

3-(2,3-Dichlorobenzoyl)-propionic Acid

Chemical Information

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Alternative Products

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