Methyl 2- (2,6-dichlorophenyl) acetate

CAT: 0127-OR95790-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR95790-01Size:1 g

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CAS Number

54551-83-6

MDL Number

MFCD00191640

Purity

98%

Smiles

O=C(OC)CC1=C(Cl)C=CC=C1Cl

Chemical Information

Methyl 2,6-dichlorophenylacetate

CAS Number	54551-83-6
PubChem CID	2734107
IUPAC Name	methyl 2-(2,6-dichlorophenyl)acetate
Molecular Formula	C9H8Cl2O2
Molecular Weight	219.06
XLogP	3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	174

SMILES

COC(=O)CC1=C(C=CC=C1Cl)Cl

InChI

InChI=1S/C9H8Cl2O2/c1-13-9(12)5-6-7(10)3-2-4-8(6)11/h2-4H,5H2,1H3

InChIKey

FCWRUYPZZJPCCG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 54551-83-6

CID: 2734107

Formula: C9H8Cl2O2

MW: 219.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	219.06
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	217.9901349
Monoisotopic Mass	217.9901349
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	174
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
OR1047938-01	Methyl 2-amino-2- (2,6-dichlorophenyl) acetate hydrochloride
OR1076578-01	Methyl 2- (2,5-dichlorophenyl) acetate
OR27269	Ethyl 2-{[ (2,6-dichlorophenyl) (hydroxyimino) methyl]amino}acetate
OR32988-01	Methyl 2-[ (2,5-dichlorophenyl) formamido]acetate
OR32421-01	Ethyl 2-[ (2,6-dichlorophenyl) formamido]acetate
OR27270	Ethyl 2-{[{[ (2,6-dichloroisonicotinoyl) oxy]imino} (2,6-dichlorophenyl) methyl]amino}acetate
OR1095876	(2,6-dichlorophenyl) (methyl) sulfane
OR1051750-01	Methyl 2-bromo-2- (3,5-dichlorophenyl) acetate
OR1049566-01	Methyl 2-amino-2- (2,4-dichlorophenyl) acetate hydrochloride
OR21043-01	2,4-Dichlorophenyl acetate

Catalog	Name
RG-D090339-01	Methyl 2- (2,6-Dichlorophenyl) Acetate
CDA58373-01	Methyl 2-bromo-2- (2,6-dichlorophenyl) acetate
RG-M200860-01	Methyl 2-Amino-2- (2,6-Dichlorophenyl) Acetate
NDA13526-01	Methyl 2- (4-amino-2,6-dichlorophenyl) acetate
DWB11513-01	Methyl 2-[2- (2,6-dichlorophenyl) -N-methylacetamido]acetate
WDA12966-01	Methyl 2- (2,5-dichlorophenyl) acetate
AJA22569-01	Methyl 2-chloro-2- (2,4-dichlorophenyl) acetate
RG-M200859-01	Methyl 2-Amino-2- (2,4-Dichlorophenyl) Acetate
ZZB31221-01	Methyl 2-chloro-2- (2,3-dichlorophenyl) acetate
RG-M200858-01	Methyl 2-Amino-2- (3,5-Dichlorophenyl) Acetate