2,4-dichlorophenyl acetate

CAT: 0127-OR1101173-02Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1101173-02Size:5 g

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CAS Number

6341-97-5

Purity

97%

Smiles

CC (=O) OC1=C (C=C (C=C1) Cl) Cl

Chemical Information

Phenol, 2,4-dichloro-, 1-acetate

CAS Number	6341-97-5
PubChem CID	22812
IUPAC Name	(2,4-dichlorophenyl) acetate
Molecular Formula	C8H6Cl2O2
Molecular Weight	205.03
XLogP	2.8
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	172

SMILES

CC(=O)OC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C8H6Cl2O2/c1-5(11)12-8-3-2-6(9)4-7(8)10/h2-4H,1H3

InChIKey

KGXUYVOKSRCTEK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6341-97-5

CID: 22812

Formula: C8H6Cl2O2

MW: 205.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	205.03
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	203.9744848
Monoisotopic Mass	203.9744848
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	12
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
OR1085648-01	3,4-dichlorophenyl acetate
OR80747-01	Ethyl 2- (3,4-dichlorophenyl) acetate
OR340136	Methyl 2- (4-nitrophenyl) -2- (3,4-dichlorophenyl) acetate
PC450025	Ethyl 2,2-difluoro-2- (3,4-dichlorophenyl) acetate
OR1076578-01	Methyl 2- (2,5-dichlorophenyl) acetate
OR95790-01	Methyl 2- (2,6-dichlorophenyl) acetate
OR1037384-01	Ethyl 2-chloro-2-[2- (2,4-dichlorophenyl) hydrazinylidene]acetate
OR0096-01	Ethyl (3,4-dichlorophenyl) (oxo) acetate
OR1062342	Methyl (R) -2-amino-2- (3,4-dichlorophenyl) acetate hydrochloride
OR1050336-01	Ethyl 2- (3,5-dichlorophenyl) acetate

Catalog	Name
AJA22569-01	Methyl 2-chloro-2- (2,4-dichlorophenyl) acetate
RG-M200859-01	Methyl 2-Amino-2- (2,4-Dichlorophenyl) Acetate
NDA13526-01	Methyl 2- (4-amino-2,6-dichlorophenyl) acetate
AK ML 0163-01	Ethyl 2-cyano-2- (3,4-dichlorophenyl) acetate
XZB16466-01	Methyl 2-chloro-2- (3,4-dichlorophenyl) acetate
LWC20963-01	Ethyl 2- (cyclopropylamino) -2- (2,4-dichlorophenyl) acetate hydrochloride
DWB11490-01	Methyl 2-[2- (2,4-dichlorophenyl) -N-methylacetamido]acetate
WDA12966-01	Methyl 2- (2,5-dichlorophenyl) acetate
TRC-E940928-100MG	Ethyl 2-(2,6-Dichlorophenyl)acetate
RG-D090342-01	Ethyl 2- (2,6-Dichlorophenyl) Acetate