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6-hydroxy-5-[2-(4-sulfophenyl)diazen-1-yl]naphthalene-2-sulfonic acid disodium

6-hydroxy-5-[2-(4-sulfophenyl)diazen-1-yl]naphthalene-2-sulfonic acid disodium

CAS: 2783-94-0

Formula: C16H12N2Na2O7S2

SMILES: [Na].[Na].OC1=C(N=NC2=CC=C(C=C2)S(O)(=O)=O)C2=CC=C(C=C2C=C1)S(O)(=O)=O

IUPAC: 6-hydroxy-5-[2-(4-sulfophenyl)diazen-1-yl]naphthalene-2-sulfonic acid disodium

InChI: InChI=1S/C16H12N2O7S2.2Na/c19-15-8-1-10-9-13(27(23,24)25)6-7-14(10)16(15)18-17-11-2-4-12(5-3-11)26(20,21)22;;/h1-9,19H,(H,20,21,22)(H,23,24,25);;

Composition: C (42.29%), H (2.66%), N (6.17%), Na (10.12%), O (24.65%), S (14.11%)

Molar Mass: 454.38

Atom Count: 41

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 453.98813164
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 9
Hydrogen Bond Donor Count 3
InChIKey AUGXBTCWEOTPFZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 100.05
Topological Polar Surface Area 153.69
Polarizability 38.93
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime CAS UnitPrice
98% <10 Days 2783-94-0 Quote Only