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Benzofurazan

CAT: 0024-sc-280613Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-280613Size:1 g
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CAS Number
273-09-6

Chemical Information

2,1,3-Benzoxadiazole

2,1,3-Benzoxadiazole is a benzoxadiazole.

CAS Number273-09-6
PubChem CID67501
IUPAC Name2,1,3-benzoxadiazole
Molecular FormulaC6H4N2O
Molecular Weight120.11
XLogP1.7
Topological Polar Surface Area38.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity95
SMILES
C1=CC2=NON=C2C=C1
InChI
InChI=1S/C6H4N2O/c1-2-4-6-5(3-1)7-9-8-6/h1-4H
InChIKey
AWBOSXFRPFZLOP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,1,3-Benzoxadiazole
CAS: 273-09-6
CID: 67501
Formula: C6H4N2O
MW: 120.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight120.11
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass120.032362755
Monoisotopic Mass120.032362755
Topological Polar Surface Area38.9 Ų
Heavy Atom Count9
Formal Charge0
Complexity95.2
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

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Alternative Products

CatalogName
261584-01Benzofurazan
OR8306-01Ethyl benzofurazan-5-carboxylate
442358-01Benzofurazan-5-boronic Acid Pinacol Ester
HY-W273413-014-Hydrazino-7-nitro-benzofurazan hydrazine adduct
MBS58249854-(2-Aminoethylamino)-7-(N,N-dimethylsulfamoyl)benzofurazan
428523-014- (2-Aminoethylamino) -7- (N, N-dimethylsulfamoyl) benzofurazan
OR05406-Hydroxy-7,8,9,10-tetrahydroindolo[3,2-e]benzofurazan-3-oxide

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