CAS 6265-74-3 N-(2-Hydroxyethyl)-4-pyridinecarboxamide (HCID 73327)

Substructure search Find similar structures

Basic information

CAS: 6265-74-3
Standard SMILES: O=C(NCCO)c1ccncc1
InChIKey: QVPWDPDVDVVXIB-UHFFFAOYSA-N
Molecular formula: C8H10N2O2
Average molar mass: 166.18 g/mol
Monoisotopic mass: 166.07422756

Names & identifiers

Preferred name: N-(2-Hydroxyethyl)-4-pyridinecarboxamide
IUPAC: N-(2-Hydroxyethyl)pyridine-4-carboxamide
English name: N-(2-Hydroxyethyl)isonicotinamide, 99
Molecular formula: C8H10N2O2
Molecular weight: 166.18

Names & synonyms

NSC 33143Nicodil impurity 21Nicoerdil Impurity JNicorandil Impurity JNicorandil Impurity 31Nicorandil EP Impurity 5N-HydroxyethylisonicotinamideN-(2-Hydroxyethyl)isonicotinamide, 99n-(2-hydroxyethyl)-4-pyridinecarboxamidN-(2-Hydroxyethyl)-4-pyridinecarboxamide

Database identifiers

CAS: 6265-74-3
PubChem CID: 73327
DTXSID: DTXSID9064184
ChEMBL: CHEMBL3264038
UNII: 923BQ8X2VH
EC Number: 228-432-7
Nikkaji: J211.497F

Properties

Physicochemical properties

Melting point: 136 · 136-138 °C(lit.)
Boiling point: 220 °C · 220 °C(lit.)
Density: 1.2265 · 1.2265 (rough estimate)
refractive index: 1.618 · 1.6180 (estimate)
storage temp.: 2 · 2-8°C
pka: 12.63 · 12.63±0.46(Predicted)
InChI: InChI=1S/C8H10N2O2/c11-6-5-10-8(12)7-1-3-9-4-2-7/h1-4,11H,5-6H2,(H,10,12)
InChIKey: QVPWDPDVDVVXIB-UHFFFAOYSA-N
SMILES: C1=NC=CC(C(NCCO)=O)=C1
FDA UNII: 923 BQ8X2VH · 923BQ8X2VH
EPA Substance Registry System: N-(2-Hydroxyethyl)-4-pyridinecarboxamide (6265-74-3)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H335-H315
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-37/39
WGK Germany: 3 · 3
TSCA: TSCA listed

Safety & regulation

Safety data

wgk: 3
tsca: TSCA listed
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-37/39
Hazard statements: H319-H335-H315
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P