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3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidaniumylideneethylidene]triaz-1-en-1-ide

3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidaniumylideneethylidene]triaz-1-en-1-ide

Formula: C10H9N3O3

SMILES: [N-]=NN=CC(=[OH+])C1=CC2=C(OCCO2)C=C1

IUPAC: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidaniumylideneethylidene]triaz-1-en-1-ide

InChI: InChI=1S/C10H8N3O3/c11-13-12-6-8(14)7-1-2-9-10(5-7)16-4-3-15-9/h1-2,5-6H,3-4H2/q-1/p+1

Composition: C (54.79%), H (4.14%), N (19.17%), O (21.90%)

Molar Mass: 219.2

Atom Count: 25

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 219.064391162
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey FYPXQDPBURLFSD-UHFFFAOYSA-O
Lipinski's Rule of Five 1
Molar Refractivity 68.16
Topological Polar Surface Area 94.39
Polarizability 21.06
Ring Count 2
Rotatable Bond Count 3

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C10H9N3O3 $3,036.00-$4,410.00$3,036.00$3,740.00$4,410.00
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