AG003UBC

7063-24-3 | Sodium 2-(4-nitrophenyl)acetate

AG003UBC

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CAS Number	7063-24-3
Catalog Number	AG003UBC(AGN-PC-0TYEAN)
Chemical Name	Sodium 2-(4-nitrophenyl)acetate
IUPAC Name	sodium;2-(4-nitrophenyl)acetate
InChI	InChI=1S/C8H7NO4.Na/c10-8(11)5-6-1-3-7(4-2-6)9(12)13;/h1-4H,5H2,(H,10,11);/q;+1/p-1
InChI Key	ZHBWMCGLXGDFAV-UHFFFAOYSA-M
MDL Number	MFCD00070537
Molecular Formula	C8H6NNaO4
Molecular Weight	203.1273
SMILES	O=C([O-])CC1=CC=C([N+]([O-])=O)C=C1.[Na+]
Synonyms	Sodium 4-Nitrophenylacetate, 7063-24-3, 4-Nitrophenylacetic Acid Sodium Salt, Sodium 2-(4-nitrophenyl)acetate, ACMC-209ofe, sodium-4-nitrophenylacetate, Sodium (4-nitrophenyl)acetate, SCHEMBL1369962, CTK8B2204, DTXSID10506508, ANW-35928, MFCD00070537, AKOS025295651, VZ29619, TC-124673, FT-0636346, N0391, Benzeneacetic acid,4-nitro-, sodium salt (1:1), 4-NITROPHENYLACETICACIDSODIUMSALT,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.019g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.129g/mol
Monoisotopic Mass	203.019g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	86A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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