AG003MSW

1060804-48-9 | 5-Hydroxynicotinaldehyde

AG003MSW

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CAS Number	1060804-48-9
Catalog Number	AG003MSW(AGN-PC-080TXQ)
Chemical Name	5-Hydroxynicotinaldehyde
IUPAC Name	5-hydroxypyridine-3-carbaldehyde
InChI	InChI=1S/C6H5NO2/c8-4-5-1-6(9)3-7-2-5/h1-4,9H
InChI Key	LMCXPBAARDWGRD-UHFFFAOYSA-N
MDL Number	MFCD13189119
Molecular Formula	C6H5NO2
Molecular Weight	123.1094
SMILES	O=CC1=CN=CC(O)=C1
Synonyms	5-hydroxynicotinaldehyde, 1060804-48-9, 5-Hydroxypyridine-3-carbaldehyde, 5-Hydroxy-pyridine-3-carbaldehyde, 5-FORMYL-3-HYDROXYPYRIDINE, PubChem23673, 3-Formyl-5-hydroxypyridine, SCHEMBL14166301, CTK8E5243, DTXSID50677246, 5-Hydroxypyridine-3-carboxaldehyde, KS-000001MC, MFCD13189119, ZINC66327857, 3-Pyridinecarboxaldehyde, 5-hydroxy-, AKOS015891922, AB67779, DS-6766, QC-4126, AK139755, CJ-21291, AB0066117, AJ-116072, DB-083218, TX-017212, CS-0063897, FT-0727154, C-0032, I02-2180, 5-hydroxypyridine-3-carbaldehyde, 95% - 1G 1g,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	123.032g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	123.111g/mol
Monoisotopic Mass	123.032g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number