AG005RF6

716-43-8 | methyl 2-(2-methoxy-2-oxoethyl)benzenecarboxylate

AG005RF6

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CAS Number	716-43-8
Catalog Number	AG005RF6(AGN-PC-0JNRKN)
Chemical Name	methyl 2-(2-methoxy-2-oxoethyl)benzenecarboxylate
IUPAC Name	methyl 2-(2-methoxy-2-oxoethyl)benzoate
InChI	InChI=1S/C11H12O4/c1-14-10(12)7-8-5-3-4-6-9(8)11(13)15-2/h3-6H,7H2,1-2H3
InChI Key	ROMWRJNZSHFGEK-UHFFFAOYSA-N
MDL Number	MFCD11053807
Molecular Formula	C11H12O4
Molecular Weight	208.2106
NSC Number	76500
SMILES	O=C(OC)C1=CC=CC=C1CC(OC)=O
Synonyms	Methyl 2-(2-methoxy-2-oxoethyl)benzoate, 716-43-8, Methyl 2-(2-methoxy-2-oxoethyl)benzenecarboxylate, Benzeneacetic acid, 2-(methoxycarbonyl)-, methyl ester, dimethyl homophthalate, ROMWRJNZSHFGEK-UHFFFAOYSA-N, NSC76500, ACMC-209oji, AC1Q5ZUK, AC1L5O9Q, NCIOpen2_003875, SCHEMBL1567249, CTK5D4774, DTXSID80291570, ZINC1707919, 1122AC, ANW-36076, BBL100969, methylmethoxyoxoethylbenzenecarboxylate, MFCD11053807, NSC-76500, SBB094029, STL554763, AKOS005071129, RP12117, KS-0000205I, AJ-30692, CJ-06762, TR-030847, FT-0680634, Methyl 2-(2-methoxy-2-oxoethyl)benzoate #, methyl 2-[2-(methoxycarbonyl)phenyl]acetate, 8B-035, B-5582, (o-Methoxycarbonylphenyl)acetic acid methyl ester, Phenylacetic acid, 2-carbmethoxy-, methyl(ester), J-521816, Benzeneacetic acid,2-(methoxycarbonyl)-, methyl ester, I01-14498, (ORTHO-METHOXYCARBONYL)PHENYLACETIC ACID METHYL ESTER, METHYL2- BENZENECARBOXYLATE, C11H12O4, AR-1H8430, CID253507, (2-methoxy-2-oxoethyl)benzenecarboxylate, 7248-19-3,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.074g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	208.213g/mol
Monoisotopic Mass	208.074g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code

Certificate of Analysis

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