AG001LGU

14920-87-7 | Benzoic acid, 2,6-dichloro-, methyl ester

AG001LGU

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CAS Number	14920-87-7
Catalog Number	AG001LGU(AGN-PC-0JTKCQ)
Chemical Name	Benzoic acid, 2,6-dichloro-, methyl ester
IUPAC Name	methyl 2,6-dichlorobenzoate
InChI	InChI=1S/C8H6Cl2O2/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4H,1H3
InChI Key	HEYGSGDIWJDORA-UHFFFAOYSA-N
MDL Number	MFCD01313701
Molecular Formula	C8H6Cl2O2
Molecular Weight	205.0380
SMILES	O=C(OC)C1=C(Cl)C=CC=C1Cl
Synonyms	Methyl 2,6-dichlorobenzoate, 14920-87-7, Benzoic acid, 2,6-dichloro-, methyl ester, 2,6-Dichlorobenzoic acid methyl ester, HEYGSGDIWJDORA-UHFFFAOYSA-N, AC1LCD2Z, SCHEMBL517538, ACMC-209d24, Methyl 2,6-dichlorobenzoate #, CTK4C6081, DTXSID20344796, METHYL2,6-DICHLOROBENZOATE, ZINC2243825, ANW-21194, MFCD01313701, AKOS008904358, MCULE-4881838490, CJ-08040, Benzoic acid,2,6-dichloro-, methyl ester, DB-004198, TC-109939, FT-0693516, ST50407476, B-7297, I01-11492, InChI=1/C8H6Cl2O2/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4H,1H, 4-MethylcinnamicAcid, CID599542,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	205.034g/mol
Monoisotopic Mass	203.974g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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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