AG005DFZ

788081-99-2 | Methyl 2-(bromomethyl)-5-methoxybenzoate

AG005DFZ

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CAS Number	788081-99-2
Catalog Number	AG005DFZ(AGN-PC-09RR70)
Chemical Name	Methyl 2-(bromomethyl)-5-methoxybenzoate
IUPAC Name	methyl 2-(bromomethyl)-5-methoxybenzoate
InChI	InChI=1S/C10H11BrO3/c1-13-8-4-3-7(6-11)9(5-8)10(12)14-2/h3-5H,6H2,1-2H3
InChI Key	GQGYGEVWBRHRTD-UHFFFAOYSA-N
MDL Number	MFCD11505947
Molecular Formula	C10H11BrO3
Molecular Weight	259.0965
SMILES	O=C(OC)C1=CC(OC)=CC=C1CBr
Synonyms	Methyl 2-(bromomethyl)-5-methoxybenzoate, 788081-99-2, AK100623, 2-(Bromomethyl)-5-methoxy-benzoic acid methyl ester, Benzoic acid, 2-(bromomethyl)-5-methoxy-, methyl ester, 2-BROMOMETHYL-5-METHOXY-BENZOIC ACID METHYL ESTER, SCHEMBL149036, CTK2G4850, DTXSID60695951, GQGYGEVWBRHRTD-UHFFFAOYSA-N, 2336AC, ANW-70069, MFCD11505947, ZINC82046751, AKOS016001760, AB64108, CS-W008825, DS-3572, Methyl 2-bromomethyl-5-methoxybenzoate, SC-84070, AJ-124446, AX8241558, DB-075522, TC-158814, FT-0762059, ST24025185, Z-5699, 2-Bromomethyl-5-methoxybenzoic acid methyl ester, C10H11BrO3, Methyl2-(bromomethyl)-5-methoxybenzoate, 2-BROMOMETHYL-5-METHOXY-BENZOICACIDMETHYLESTER,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.989g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	259.099g/mol
Monoisotopic Mass	257.989g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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