Nicorandil Impurity 57

CAT: 1299-RM-N031884-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-N031884-01Size:10 mg

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CAS Number

41116-47-6

Synonyms

N-ethylpicolinamide

Molecular Formula

C8H10N2O

Molecular Weight

150.18

Target Alternative Name

Nicorandil

Product Name Synonym

N-ethylpicolinamide

Chemical Information

N-Ethylpicolinamide

CAS Number	41116-47-6
PubChem CID	11958971
IUPAC Name	N-ethylpyridine-2-carboxamide
Molecular Formula	C8H10N2O
Molecular Weight	150.18
XLogP	0.3
Topological Polar Surface Area	42
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	136

SMILES

CCNC(=O)C1=CC=CC=N1

InChI

InChI=1S/C8H10N2O/c1-2-9-8(11)7-5-3-4-6-10-7/h3-6H,2H2,1H3,(H,9,11)

InChIKey

CYHDKNQVKVBPNY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 41116-47-6

CID: 11958971

Formula: C8H10N2O

MW: 150.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	150.18
XLogP3	0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	150.079312947
Monoisotopic Mass	150.079312947
Topological Polar Surface Area	42 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	136
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-N031840-01	Nicorandil Impurity 14 (Nicorandil Trimer)
RM-N031831-01	Nicorandil Impurity 5
RM-N031830-01	Nicorandil Impurity 4
RM-N031885-01	Nicorandil Impurity 58
RM-N031883-01	Nicorandil Impurity 56
RM-N031898-01	Nicorandil Impurity 70
RM-N031908-01	Nicorandil Impurity 79
RM-N031880-01	Nicorandil Impurity 53
RM-N031853-01	Nicorandil Impurity 27
RM-N031854-01	Nicorandil Impurity 28

Catalog	Name
AR-N01394-01	Nicorandil EP Impurity A (p-Nicorandil)
AR-N08546-01	Nicorandil Impurity 21
AR-N08566-01	Nicorandil Impurity 39
AR-N08549-01	Nicorandil Impurity 24
AR-N08553-01	Nicorandil Impurity 28
AR-N08986-01	Nicorandil Impurity 9
AR-N01402-01	Nicorandil Impurity 5
AR-N08535-01	Nicorandil Impurity 6
AR-N08538-01	Nicorandil Impurity 10
AR-N08539-01	Nicorandil Impurity 12