AG000WIN

127-68-4 | Benzenesulfonic acid, 3-nitro-, sodium salt (1:1)

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CAS Number	127-68-4
Catalog Number	AG000WIN(AGN-PC-0PILX7)
Chemical Name	Benzenesulfonic acid, 3-nitro-, sodium salt (1:1)
EC Number	204-857-3
IUPAC Name	sodium;3-nitrobenzenesulfonate
InChI	InChI=1S/C6H5NO5S.Na/c8-7(9)5-2-1-3-6(4-5)13(10,11)12;/h1-4H,(H,10,11,12);/q;+1/p-1
InChI Key	LJRGBERXYNQPJI-UHFFFAOYSA-M
MDL Number	MFCD02662351
Molecular Formula	C6H4NNaO5S
Molecular Weight	225.1544
SMILES	[Na+].O=N(=O)c1cccc(c1)S(=O)(=O)[O-]
UNII	1F11SXJ4C6
Synonyms	127-68-4, SODIUM 3-NITROBENZENESULFONATE, 3-Nitrobenzenesulfonic acid sodium salt, Sodium 3-nitrobenzenesulphonate, Sodium m-nitrobenzenesulfonate, Nitrol S, Tiskan [Czech], Ludigol, Ludigol F,60, Benzenesulfonic acid, 3-nitro-, sodium salt, UNII-1F11SXJ4C6, MFCD00007490, Tiskan, 3-Nitrobenzenesulfonic acid, sodium salt, HSDB 5614, NSC 9795, EINECS 204-857-3, Nitrobenzen-m-sulfonan sodny [Czech], m-Nitrobenzenesulfonic acid sodium salt, m-Nitrobenzenesulfonic acid, sodium salt, sodium m-nitrobenzene sulfonate, 1F11SXJ4C6, Benzenesulfonic acid, m-nitro-, sodium salt, sodium 3-nitrobenzene-1-sulfonate, Nitrobenzen-m-sulfonan sodny, Benzenesulfonic acid, 3-nitro-, sodium salt (1:1), m-nitrobenzene sulfonic acid sodium salt, 3-Nitrobenzenesulfonic acid, sodium salt, 99%, Resist Salt, PubChem18116, ACMC-209bcv, C6H4NNaO5S, AC1L1LIT, DSSTox_CID_7048, EC 204-857-3, DSSTox_RID_78292, DSSTox_GSID_27048, sodium 3-nitrophenylsulfonate, KSC490S9J, sodium m-nitrobezene sulfonate, SCHEMBL340713, sodium m-nitrobenzenesulphonate, sodium 3-nitro-benzenesulfonate, sodium 3-nitrobenzene sulfonate, sodium m-nitrobenzene-sulphonate, Jsp001740, CHEMBL3188704, DTXSID2027048, sodium 3-nitrobenzene sulphonate, CTK3J0994, sodium 3-nitro-benzene sulfonate, LJRGBERXYNQPJI-UHFFFAOYSA-M, 3-nitrobenzene sulfonate sodium salt, Tox21_200902, ANW-18989, Sodium 3-nitrobenzenesulfonate, 98%, 3-nitrobenzensulfonic acid sodium salt, AKOS015900868, NE10492, RP27579, RTR-003957, TRA0073544, 3-nitro-phenylsulfonic acid sodium salt, 3-nitro benzenesulfonic acid sodium salt, 3-nitro-benzenesulfonic acid sodium salt, 3-nitrobenzene sulfonic acid sodium salt, m-nitrobenzene sulphonic acid sodium salt, NCGC00258456-01, 3-nitrobenzene sulphonic acid sodium salt, AC-11596, AK308476, AN-23006, AS-12915, CAS-127-68-4, LS-32039, SC-18992, m-NITROBENZENESULFONIC ACID, Na SALT, TL8000682, TR-003957, FT-0616236, N0141, 3-Nitrobenzenesulfonic acid sodium salt hydrate, W-108378, I14-16348, F1113-0115, Nacan, C6H4NO5S.Na, C6H5NO5S.Na, C6-H5-N-O5-S.Na, Sodium-3-nitrobenzenesulphonate, potassium 3-nitrobenzenesulfonate, Sodium 3- nitrobenzenesulphonate, CID31389, 3-Nitrobenzenesulphonic acid sodium salt, Nitrobenzenesulfonic acid, sodium salt, 3-, Acide m-nitrobenznesulfonique, sel de sodium, Sodium 3-nitrobenzenesulfonate hydrate, 98% 100g, Sodium 3-nitrobenzenesulfonate, 96% - 2.5KG 2.5kg,

Complexity	274
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.971g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	225.15g/mol
Monoisotopic Mass	224.971g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	111A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number