AG007A93

35598-05-1 | Methyl 4-methoxy-2-methylbenzoate

AG007A93

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CAS Number	35598-05-1
Catalog Number	AG007A93(AGN-PC-00LPZE)
Chemical Name	Methyl 4-methoxy-2-methylbenzoate
IUPAC Name	methyl 4-methoxy-2-methylbenzoate
InChI	InChI=1S/C10H12O3/c1-7-6-8(12-2)4-5-9(7)10(11)13-3/h4-6H,1-3H3
InChI Key	OGYAVWKYDVBIMW-UHFFFAOYSA-N
MDL Number	MFCD06203918
Molecular Formula	C10H12O3
Molecular Weight	180.2005
SMILES	O=C(OC)C1=CC=C(OC)C=C1C
Synonyms	Methyl 4-methoxy-2-methylbenzoate, 35598-05-1, 4-METHOXY-2-METHYL-BENZOIC ACID METHYL ESTER, Benzoic acid, 4-methoxy-2-methyl-, methyl ester, Methyl 2-Methyl-p-anisate, SCHEMBL1179412, CTK4H4897, KS-00003TAK, DTXSID70532464, OGYAVWKYDVBIMW-UHFFFAOYSA-N, 7404AH, MFCD06203918, ZINC20154683, 2-Methyl-p-anisic Acid Methyl Ester, 4-Methoxy-o-toluic Acid Methyl Ester, AKOS000297765, methyl 2-methyl-4-(methyloxy)benzoate, AS07026, RL03344, AJ-76113, AK-46876, SC-68571, TS-02519, AB0048672, 2-Methyl-4-methoxybenzoic acid methyl ester, 4-Methoxy-2-methylbenzoic Acid Methyl Ester, 4CH-005488, BB 0245779, CS-0043197, FT-0687137, M2889, 2-methyl-4-methoxy-benzoic acid methyl ester, 4-Methyloxy-2-methylbenzoic acid methyl ester, 4-Methoxy-2-methyl-benzoic acid methyl ester, L-1227, Benzoic acid,4-methoxy-2-methyl-, methyl ester, 598M051, J-522367, Methyl 4-methoxy-o-toluate, Methyl4-methoxy-2-methylbenzoate, C10H12O3,

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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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