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2,6-Naphthalenedisulfonicacid, 2,6-dihydrazide

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Name

2,6-Naphthalenedisulfonicacid, 2,6-dihydrazide

EINECS 281-113-4
CAS No. 83863-50-7 Density N/A
PSA 161.14000 LogP 3.48780
Solubility N/A Melting Point N/A
Formula C10H12N4O4S2 Boiling Point N/A
Molecular Weight 316.35668 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 83863-50-7 (naphthalene-2,6-di(sulphonohydrazide)) Hazard Symbols N/A
Synonyms

2,6-Naphthalenedisulfonicacid, dihydrazide (9CI);

 

2,6-Naphthalenedisulfonicacid, 2,6-dihydrazide Specification

The 2,6-Naphthalenedisulfonicacid, 2,6-dihydrazide, with the CAS registry number 83863-50-7, is also known as 2,6-Naphthalenedisulfonic acid dihydrazide. Its EINECS registry number is 281-113-4. This chemical's molecular formula is C10H12N4O4S2 and molecular weight is 316.35668. What's more, its IUPAC name is called Naphthalene-2,6-disulfonohydrazide.

Properties Computed from Structure about 2,6-Naphthalenedisulfonicacid, 2,6-dihydrazide are: (1)XLogP3-AA -0.4; (2)H-Bond Donor 4; (3)H-Bond Acceptor 8; (4)Rotatable Bond Count 4; (5)Exact Mass 316.029996; (6)MonoIsotopic Mass 316.029996; (7)Topological Polar Surface Area 161; (8)Heavy Atom Count 20; (9)Formal Charge 0; (10)Complexity 487; (11)Isotope Atom Count 0; (12)Defined Atom StereoCenter Count 0; (13)Undefined Atom StereoCenter Count 0; (14)Defined Bond StereoCenter Count 0; (15)Undefined Bond StereoCenter Count 0; (16)Covalently-Bonded Unit Count 1; (17)Feature 3D Acceptor Count 4; (18)Feature 3D Donor Count 2; (19)Feature 3D Ring Count 2; (20)Effective Rotor Count 4; (21)Conformer Sampling RMSD 0.6; (22)CID Conformer Count 9.

You can still convert the following datas into molecular structure:
(1) SMILES: C1=CC2=C(C=CC(=C2)S(=O)(=O)NN)C=C1S(=O)(=O)NN
(2) InChI: InChI=1S/C10H12N4O4S2/c11-13-19(15,16)9-3-1-7-5-10(20(17,
18)14-12)4-2-8(7)6-9/h1-6,13-14H,11-12H2
(3) InChIKey: PVXKWNACCHLGEO-UHFFFAOYSA-N

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