Methanethiol, N-cyclooctylamidino-, hydrogen sulfate (ester) structure

Methanethiol, N-cyclooctylamidino-, hydrogen sulfate (ester)

[(1-amino-2-sulfosulfanylethylidene)amino]cyclooctane

Also Known As: S-((N-Cyclooctylamidino)methyl) hydrogen thiosulfate|Methanethiol, N-cyclooctylamidino-, hydrogen sulfate (ester)|[(1-amino-2-sulfosulfanylethylidene)amino]cyclooctane|s-[(2z)-2-amino-2-(cyclooctylimino)ethyl] hydrogen sulfurothioate|{[(N-cyclooctylcarbamimidoyl)methyl]sulfanyl}sulfonic acid|Thiosulfuric acid (H2S2O3), S-[2-(cyclooctylamino)-2-iminoethyl] ester|Thiosulfuric acid hydrogen S-[2-(cyclooctylamino)-2-iminoethyl] ester

CAS: 5326-74-9
Molecular Formula C10H20N2O3S2
Molecular Weight 280.09152 g/mol
LogP 1.5
Topological Polar Surface Area 126.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 280.09152
Monoisotopic Mass 280.09152
Heavy Atoms 17
Complexity 341.0

Chemical Identifiers

CAS Number 5326-74-9
SMILES C1CCCC(CCC1)N=C(CSS(=O)(=O)O)N
InChIKey RRXBGHRARYBGOA-UHFFFAOYSA-N

Product Overview

Methanethiol, N-cyclooctylamidino-, hydrogen sulfate (ester) (CAS 5326-74-9), with molecular formula C10H20N2O3S2 and molecular weight 280.09152 g/mol. IUPAC: [(1-amino-2-sulfosulfanylethylidene)amino]cyclooctane.

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