AG003RM5

57486-70-1 | methyl 2-(4-(methylsulfonamido)phenyl)acetate

AG003RM5

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CAS Number	57486-70-1
Catalog Number	AG003RM5(AGN-PC-0WADQP)
Chemical Name	methyl 2-(4-(methylsulfonamido)phenyl)acetate
IUPAC Name	methyl 2-[4-(methanesulfonamido)phenyl]acetate
InChI	InChI=1S/C10H13NO4S/c1-15-10(12)7-8-3-5-9(6-4-8)11-16(2,13)14/h3-6,11H,7H2,1-2H3
InChI Key	KYOSZSOSUVEMFQ-UHFFFAOYSA-N
MDL Number	MFCD21641341
Molecular Formula	C10H13NO4S
Molecular Weight	243.2795
SMILES	O=C(OC)CC1=CC=C(NS(=O)(C)=O)C=C1
Synonyms	57486-70-1, Methyl 2-[4-(Methylsulfonamido)phenyl]acetate, Methyl 2-(4-(methylsulfonamido)phenyl)acetate, 4-[(methylsulfonyl)amino]Benzeneacetic acid methyl ester, KYOSZSOSUVEMFQ-UHFFFAOYSA-N, 6933AJ, KM0112, MFCD21641341, ZINC90514050, AKOS022184147, TRA-0184300, AS-32074, DA-18015, SY019025, AX8268536, TC-308422, FT-0706123, methyl 2-[4-(methanesulfonamido)phenyl]acetate, MFCD21641341 (97+%), METHYL 2-(4-METHANESULFONAMIDOPHENYL)ACETATE, 4-[(Methylsulfonyl)amino]benzeneacetic acid, methyl ester, C10H13NO4S, 500-22-1,

Complexity	325
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.057g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	243.277g/mol
Monoisotopic Mass	243.057g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	80.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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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