Ethionamide Impurity 1

CAT: 1596-AR-E10605-03Size: 50 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-E10605-03Size:50 Units

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CAS Number

3376-95-2

Molecular Formula

C8H10N2O

Molecular Weight

150.18

API Name

Ethionamide

Chemical Information

2-Ethylisonicotinamide

CAS Number	3376-95-2
PubChem CID	76905
IUPAC Name	2-ethylpyridine-4-carboxamide
Molecular Formula	C8H10N2O
Molecular Weight	150.18
XLogP	0.5
Topological Polar Surface Area	56
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	147

SMILES

CCC1=NC=CC(=C1)C(=O)N

InChI

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

InChIKey

LWTBJUQFUISATQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3376-95-2

CID: 76905

Formula: C8H10N2O

MW: 150.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	150.18
XLogP3	0.5
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	56 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	147
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
AR-E02041-01	Ethionamide
AR-E02044-01	Ethionamide-d3
AR-E10606-01	Ethionamide-d3
AR-E02042-01	Ethionamide-d5
AR-E02043-01	Ethionamide Sulfoxide
AR-N01491-01	Nifedipine Impurity 1 (Benidipine Impurity 5)
AR-B01168-01	Benidipine Impurity 5 (Nifedipine Impurity 1)
AR-E10592-01	MTBE Impurity 1 and MTBE Impurity 2
AR-L01467-01	Levocabastine Impurity 1
AR-L06945-01	Levamisole Impurity 1

Catalog	Name
A8429-1000	Ethionamide