2- (2,6-dichlorophenoxy) acetic Acid

CAT: 0926-AAA57590-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0926-AAA57590-01Size:1 g

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CAS Number

575-90-6

MDL Number

MFCD00272886

Smiles

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

Molecular Formula

C8H6O3Cl2

Molecular Weight

221.03 g/mol

Controlled

Chemical Information

2,6-Dichlorophenoxyacetic acid

CAS Number	575-90-6
PubChem CID	11332
IUPAC Name	2-(2,6-dichlorophenoxy)acetic acid
Molecular Formula	C8H6Cl2O3
Molecular Weight	221.03
XLogP	2.7
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	176

SMILES

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

InChI

InChI=1S/C8H6Cl2O3/c9-5-2-1-3-6(10)8(5)13-4-7(11)12/h1-3H,4H2,(H,11,12)

InChIKey

KHZWIIFEFQBNKL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 575-90-6

CID: 11332

Formula: C8H6Cl2O3

MW: 221.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	221.03
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	219.9693994
Monoisotopic Mass	219.9693994
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	176
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
AAA58764-01	2- (3,5-Dichlorophenoxy) acetic acid
AAA58822	2- (3,4-Dichlorophenoxy) acetic acid
FD70067-01	(2,4-Dichlorophenoxy) acetic acid methyl ester
UEA41170	4- (2,6-Dichlorophenoxy) butanoic acid
FD16017-01	(2,4-Dichlorophenoxy) acetic acid sodium salt monohydrate
RRB55542-01	2-Chloro-6- (2,4-dichlorophenoxy) benzoic acid
AEA25633-01	2- (2,6-Diethylphenyl) acetic acid
QAA56150-01	2- (2,6-Dimethoxyphenyl) acetic acid
WAA24845	(2,6-Dichlorophenylthio) acetic acid
FD22390-01	(2,6-Dimethylphenoxy) acetic acid

Catalog	Name
JH350884	2- (2,6-dichlorophenoxy) acetic acid
DB0166	2, 4-Dichlorophenoxy acetic acid
sc-205097A	2,4-Dichlorophenoxy Acetic Acid
sc-304573	2- (2-Bromo-4,6-dichlorophenoxy) acetic acid
CS-M-17761	(2,3-Dichlorophenoxy) acetic acid
sc-275402	(2,5-dichlorophenoxy) acetic acid
OR76290-01	2- (2,5-Dichlorophenoxy) acetic acid
TRC-D435689-5MG	(2,4-Dichlorophenoxy-d3)acetic Acid
OR452057-01	2- (3,4-Dichlorophenoxy) acetic acid
AR-A01216-01	Bis (2,4-Dichlorophenoxy) acetic Acid