AG003RX8

39503-51-0 | Methyl 5-bromo-2,4-dimethoxybenzoate

AG003RX8

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CAS Number	39503-51-0
Catalog Number	AG003RX8(AGN-PC-0L14HH)
Chemical Name	Methyl 5-bromo-2,4-dimethoxybenzoate
IUPAC Name	methyl 5-bromo-2,4-dimethoxybenzoate
InChI	InChI=1S/C10H11BrO4/c1-13-8-5-9(14-2)7(11)4-6(8)10(12)15-3/h4-5H,1-3H3
InChI Key	VJROGSBBDLIEMZ-UHFFFAOYSA-N
MDL Number	MFCD05154996
Molecular Formula	C10H11BrO4
Molecular Weight	275.0959
SMILES	O=C(OC)C1=CC(Br)=C(OC)C=C1OC
Synonyms	methyl 5-bromo-2,4-dimethoxybenzoate, 39503-51-0, 5-bromo-2,4-dimethoxybenzoic acid methyl ester, Methyl 5-bromo-2,4-dimethoxy-benzoate, AC1MYN4O, SCHEMBL383036, Benzoic acid, 5-bromo-2,4-dimethoxy-, methyl ester, CTK4I1441, DTXSID40397461, VJROGSBBDLIEMZ-UHFFFAOYSA-N, ZINC2544774, ANW-44254, MFCD05154996, AKOS015852337, CM-1649, MCULE-7870742053, TRA0031906, ACM39503510, AJ-39226, AK-92986, BBV-44250576, methyl 5-bromanyl-2,4-dimethoxy-benzoate, AB0000245, AX8224292, TC-067048, 4CH-011301, FT-0658251, ST24025406, S-0062, A824577, Benzoic acid,5-bromo-2,4-dimethoxy-, methyl ester, I14-5155, 5-Bromo-2-methylbenzenamine, ACN-031340, CID3859236,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	273.984g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	275.098g/mol
Monoisotopic Mass	273.984g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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