AG003Q2O

81055-73-4 | Ethyl 2,6-Dichlorobenzoate

AG003Q2O

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CAS Number	81055-73-4
Catalog Number	AG003Q2O(AGN-PC-0KK8IS)
Chemical Name	Ethyl 2,6-Dichlorobenzoate
IUPAC Name	ethyl 2,6-dichlorobenzoate
InChI	InChI=1S/C9H8Cl2O2/c1-2-13-9(12)8-6(10)4-3-5-7(8)11/h3-5H,2H2,1H3
InChI Key	HAFAMHIZRCDTSS-UHFFFAOYSA-N
MDL Number	MFCD01313702
Molecular Formula	C9H8Cl2O2
Molecular Weight	219.0646
SMILES	C1(C(Cl)=CC=CC=1Cl)C(=O)OCC
Synonyms	ethyl 2,6-dichlorobenzoate, 81055-73-4, 2,6-Dichlorobenzoic acid ethyl ester, MFCD01313702, ETHYL2,6-DICHLOROBENZOATE, AC1MC7BF, SCHEMBL8493097, CTK5E8418, DTXSID50372062, HAFAMHIZRCDTSS-UHFFFAOYSA-N, KS-00002BK3, STR08820, ZINC2243826, AKOS008947835, MCULE-6687299616, Benzoicacid, 2,6-dichloro-, ethyl ester, Benzoic acid, 2,6-dichloro-, ethyl ester, TR-025527, FT-0730421, ST50407515, ZINC02243826, CID2737439,

Complexity	175
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.99g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	219.061g/mol
Monoisotopic Mass	217.99g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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