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Isoniazid

CAT: 1596-AR-I01854-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-I01854-02Size:25 Units
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CAS Number
54-85-3
Synonyms
Isonicotinohydrazide;4-Pyridinecarboxylic Acid Hydrazide; Isonicotinic Acid Hydrazide; 4- (Hydrazinocarbonyl) pyridine; 4-Pyridinecarbonylhydrazine; 4-Pyridinecarboxylic Hydrazide; 4-Pyridylcarbonylhydrazide; 5015 R.P.; Armazid; Armazide; Atcotibine; Isonizide; Isotebezid; Isozide; Robisellin; Sauterazid; Zinadon; Zonazide; Tubazid; Isoniazid
Molecular Formula
C6H7N3O
Molecular Weight
137.14
API Name
Isoniazid

Chemical Information

Isoniazid

Isoniazide is a carbohydrazide obtained by formal condensation between pyridine-4-carboxylic acid and hydrazine. It has a role as an antitubercular agent and a drug allergen. It is functionally related to an isonicotinic acid.

CAS Number54-85-3
PubChem CID3767
IUPAC Namepyridine-4-carbohydrazide
Molecular FormulaC6H7N3O
Molecular Weight137.14
XLogP-0.7
Topological Polar Surface Area68
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity120
SMILES
C1=CN=CC=C1C(=O)NN
InChI
InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
InChIKey
QRXWMOHMRWLFEY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Isoniazid
CAS: 54-85-3
CID: 3767
Formula: C6H7N3O
MW: 137.14
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight137.14
XLogP3-0.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass137.058911855
Monoisotopic Mass137.058911855
Topological Polar Surface Area68 Ų
Heavy Atom Count10
Formal Charge0
Complexity120
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
B1957-5.1Isoniazid

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