AG00DCW5

5402-20-0 | 4-PYRIDINESULPHONIC ACID

AG00DCW5

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CAS Number	5402-20-0
Catalog Number	AG00DCW5(AGN-PC-0JNANS)
Chemical Name	4-PYRIDINESULPHONIC ACID
IUPAC Name	pyridine-4-sulfonic acid
InChI	InChI=1S/C5H5NO3S/c7-10(8,9)5-1-3-6-4-2-5/h1-4H,(H,7,8,9)
InChI Key	PTWLOSARXIJRRJ-UHFFFAOYSA-N
MDL Number	MFCD00234082
Molecular Formula	C5H5NO3S
Molecular Weight	159.1631
NSC Number	5082
SMILES	OS(=O)(=O)C1=CC=NC=C1
Synonyms	pyridine-4-sulfonic acid, 5402-20-0, 4-Pyridinesulfonic acid, 4-PYRIDINESULPHONIC ACID, Pyridine-4-sulphonic acid, 4-Pyridinesulfonicacid, ACMC-1AYSO, AC1Q6WTZ, AC1L59T9, SCHEMBL1416290, CTK1H2046, KS-00002AWD, NSC5082, NSC-5082, ZINC6500274, ANW-59174, CP-843, MFCD00234082, AKOS015891504, PS-8788, QC-4140, RP02076, VP14752, AJ-56286, AM100922, AN-25190, AB0041609, AB1009781, DB-031423, ST2405942, TC-147919, 4CH-018901, FT-0084709, FT-0645409, Y9394, K-9766, I02-0439, J-524123, [6R-[6|A,7|A(R*)]]-7-[[[[(4-Ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino](4-|hydroxyphenyl)acetyl]amino]-3-[[(1-methyl-1Htetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, C5H5NO3S, AR-1G4538, CID221127, ACN-027397, A7853, 6140-75-6,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.999g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	159.159g/mol
Monoisotopic Mass	158.999g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
Siginal words

Certificate of Analysis

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