AG003NO0

580-02-9 | Methyl 2-acetoxybenzoate

AG003NO0

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CAS Number	580-02-9
Catalog Number	AG003NO0(AGN-PC-0JL8HQ)
Chemical Name	Methyl 2-acetoxybenzoate
EC Number	209-450-4
IUPAC Name	methyl 2-acetyloxybenzoate
InChI	InChI=1S/C10H10O4/c1-7(11)14-9-6-4-3-5-8(9)10(12)13-2/h3-6H,1-2H3
InChI Key	ONWPLBKWMAUFGZ-UHFFFAOYSA-N
MDL Number	MFCD00014978
Molecular Formula	C10H10O4
Molecular Weight	194.1840
NSC Number	403847
SMILES	O=C(OC)C1=CC=CC=C1OC(C)=O
UNII	7FX481V180
Synonyms	acetylsalicylic acid methyl ester, methyl acetylsalicylic acid, methyl aspirin, Methyl 2-Acetoxybenzoate, 580-02-9, Methyl acetylsalicylate, Methylrhodine, Acetylsalicylic acid methyl ester, Aspirin methyl ester, Methyl rhodin, Methyl o-acetoxybenzoate, Methyl O-acetylsalicylate, Methyl aspirin, UNII-7FX481V180, Salicylic acid acetate, methyl ester, methyl 2-acetyloxybenzoate, NSC 403847, Benzoic acid, 2-(acetyloxy)-, methyl ester, 2-Acetoxybenzoic Acid Methyl Ester, 7FX481V180, 2-(methoxycarbonyl)phenyl acetate, methylrodin, Methyl acetylsalicylic acid, EINECS 209-450-4, Methylacetylsalicylate, ACMC-1AXRU, AI3-02356, O-Acetyl methyl salicylate, Acetylsalicylsauremethylester, AC1L29TS, AC1Q61PB, CHEMBL163148, SCHEMBL1162463, Methyl 2-(acetyloxy)benzoate #, CTK8B1953, DTXSID20206724, ONWPLBKWMAUFGZ-UHFFFAOYSA-N, KS-000014OU, ZINC2560557, 2-Acetoxy-benzoic acid methyl ester, ANW-32855, MFCD00014978, NSC403847, SBB007836, Salicylic acid, methyl ester, acetate, AKOS006227738, FR-0426, MCULE-6223557049, NSC-403847, Salicylic acid acetate, methyl ester (8CI), TR-030569, A0114, FT-0628767, ST50828055, I01-10389, InChI=1/C10H10O4/c1-7(11)14-9-6-4-3-5-8(9)10(12)13-2/h3-6H,1-2H, Benzoic acid, methyl ester, ACETYLSALICYLICACIDMETHYLESTER, CID68484, AR-1J6728, 2-(Acetyloxy)benzoic acid methyl ester, C10-H10-O4, 59724-73-1,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	194.186g/mol
Monoisotopic Mass	194.058g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number