AG00CADI

31872-64-7 | 3-Chloro-4-hydroxy-5-nitropyridine

AG00CADI

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CAS Number	31872-64-7
Catalog Number	AG00CADI(AGN-PC-0O8V97)
Chemical Name	3-Chloro-4-hydroxy-5-nitropyridine
IUPAC Name	3-chloro-5-nitro-1H-pyridin-4-one
InChI	InChI=1S/C5H3ClN2O3/c6-3-1-7-2-4(5(3)9)8(10)11/h1-2H,(H,7,9)
InChI Key	VEOKYVSPRSTYHS-UHFFFAOYSA-N
MDL Number	MFCD11044290
Molecular Formula	C5H3ClN2O3
Molecular Weight	174.5419
SMILES	OC1=C(Cl)C=NC=C1[N+]([O-])=O
Synonyms	3-Chloro-5-nitropyridin-4-ol, 31872-64-7, 3-Chloro-4-hydroxy-5-nitropyridine, ACMC-209hpc, AC1Q789L, SCHEMBL4359807, SCHEMBL11503840, CTK4G7862, DTXSID60474405, VEOKYVSPRSTYHS-UHFFFAOYSA-N, 4-Pyridinol, 3-chloro-5-nitro-, EBD35245, ANW-27214, MFCD11044290, ZINC35270277, AKOS006307592, AJ-91102, AK-54492, DS-14479, SY033822, 3-Chloro-5-nitropyridin-4-ol, AldrichCPR, DB-068539, TR-057446, 4CH-009784, FT-0728879, ST24028489, X5153, MFCD11044290 (95%), A-6429, C5H3ClN2O3, 3-chloro-5-nitro-1H-pyridin-4-one, ACN-027065, CID11850826,

Complexity	276
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.983g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	174.54g/mol
Monoisotopic Mass	173.983g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	74.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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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