3- (2-Chlorophenoxy) propionic acid

CAT: 0127-OR470101-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR470101-01Size:100 mg

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CAS Number

7170-45-8

MDL Number

MFCD02295728

Purity

95%

Smiles

OC(=O)CCOc1ccccc1Cl

Chemical Information

3-(2-Chlorophenoxy)propionic acid

CAS Number	7170-45-8
PubChem CID	81598
IUPAC Name	3-(2-chlorophenoxy)propanoic acid
Molecular Formula	C9H9ClO3
Molecular Weight	200.62
XLogP	2.2
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	172

SMILES

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

InChI

InChI=1S/C9H9ClO3/c10-7-3-1-2-4-8(7)13-6-5-9(11)12/h1-4H,5-6H2,(H,11,12)

InChIKey

UZFYWLRSVDZCSF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7170-45-8

CID: 81598

Formula: C9H9ClO3

MW: 200.62

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	200.62
XLogP3	2.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	200.0240218
Monoisotopic Mass	200.0240218
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	172
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

Catalog	Name
OR75605-01	2- (3-Chlorophenoxy) propionic acid
OR12741-01	2- (2-chlorophenoxy) propionic acid
OR40783-01	3- (4-Chlorophenoxy) propionic acid
OR94296-01	3- (3-chlorophenoxy) propanoic acid
OR452060	2- (3-Chlorophenoxy) -2-methyl-propanoic acid
OR912090-01	2- (4-Chlorophenoxy) propanoic acid
OR82164	3- ((4- (2-Chlorophenoxy) phenyl) sulfonamido) propanoic acid
OR1001472-01	2- (4-Chlorophenoxy) -3-methylbutanoic acid
OR79369-01	(2-Chlorophenoxy) acetic acid
OR964201-01	3- (2-Thiazolyl) propionic acid

Catalog	Name
413120-01	2- (2-Chlorophenoxy) propionic acid
413416-01	2- (3-Chlorophenoxy) propionic acid
HAA17045	3- (2-Chlorophenoxy) propionic acid
abx182925-01	2-(3-Chlorophenoxy)propionic acid
DAA30739	2- (4-Chlorophenoxy) propionic acid
4332-01	3CPA (2-(3-Chlorophenoxy)-propionic acid)
229302-01	2- (2-Chlorophenoxy) Propionic Acid 99+% (HPLC)
sc-288675	3- (3-Chlorophenoxy) propionic acid
sc-231325	3- (4-Chlorophenoxy) propionic acid
GTR19252220-01	3- (P-chlorophenoxy) propionic acid