tetrakis(1-[(1-amino-2-sulfosulfanylethylidene)amino]adamantane)hydrate

tetrakis(1-[(1-amino-2-sulfosulfanylethylidene)amino]adamantane);hydrate

CAS: 63869-14-7

Molecular Formula	`C48H82N8O13S8`
Molecular Weight	1235.7 g/mol
Topological Polar Surface Area	507.0 A2
Hydrogen Bond Donors	9
Hydrogen Bond Acceptors	21
Rotatable Bonds	16
Exact Mass	1234.3767
Heavy Atoms	77
Complexity	454.0

Chemical Identifiers

CAS Number	63869-14-7
SMILES	`C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.O`
InChIKey	`INFKGGOPQPNWRD-UHFFFAOYSA-N`

📖 Product Overview

tetrakis(1-[(1-amino-2-sulfosulfanylethylidene)amino]adamantane)hydrate (CAS: 63869-14-7) is a chemical compound with molecular formula C48H82N8O13S8 and molecular weight 1235.7 g/mol. Its IUPAC systematic name is tetrakis(1-[(1-amino-2-sulfosulfanylethylidene)amino]adamantane);hydrate. Topological Polar Surface Area 507.0 A2 Hydrogen Bond Donors 9 Hydrogen Bond Acceptors 21 Rotatable Bonds 16 Exact Mass 1234.3767 Heavy Atoms 77 Complexity 454.0 InChI Key: INFKGGOPQPNWRD-UHFFFAOYSA-N. SMILES: C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.O.

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