AG00FEBJ

73502-03-1 | 5-METHOXY-2-METHYL-BENZOIC ACID METHYL ESTER

AG00FEBJ

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CAS Number	73502-03-1
Catalog Number	AG00FEBJ(AGN-PC-00FAQ4)
Chemical Name	5-METHOXY-2-METHYL-BENZOIC ACID METHYL ESTER
IUPAC Name	methyl 5-methoxy-2-methylbenzoate
InChI	InChI=1S/C10H12O3/c1-7-4-5-8(12-2)6-9(7)10(11)13-3/h4-6H,1-3H3
InChI Key	SEVHDRXGLLXUQE-UHFFFAOYSA-N
MDL Number	MFCD11045607
Molecular Formula	C10H12O3
Molecular Weight	180.2005
SMILES	O=C(OC)C1=CC(OC)=CC=C1C
Synonyms	Methyl 5-Methoxy-2-methylbenzoate, 73502-03-1, 5-METHOXY-2-METHYL-BENZOIC ACID METHYL ESTER, Benzoic acid, 5-methoxy-2-methyl-, methyl ester, 5-Methoxy-2-methylbenzoic acid methyl ester, SCHEMBL146258, KS-00003KRB, DTXSID00471650, methyl 3-methoxy-6-methylbenzoate, SEVHDRXGLLXUQE-UHFFFAOYSA-N, 4312AJ, MFCD11045607, ZINC21303538, AKOS006306584, CM12833, FS-2585, AJ-78442, SC-52597, SY025976, AB1008061, DB-074705, TL8007234, A9477, FT-0729378, MFCD11045607 (95%), Z-5841, Methyl 4-methoxy-o-toluate, methyl5-hydroxy-2-methylbenzoate, methyl 5-hydroxy-2-methylbenzoate, C10H12O3, Methyl 5-methoxy-2-methyl-benzoate, CID11745224, 5-Hydroxy-2-methyl benzoic acid methyl ester, 5-METHOXY-2-METHYL-BENZOICACIDMETHYLESTER, 73505-48-3,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.079g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	180.203g/mol
Monoisotopic Mass	180.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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