Ethanethiol, 2-(3-cyclohexylpentyl)amino-, hydrogen sulfate (ester)
(3S)-3-cyclohexyl-N-(2-hydroxysulfonothioyloxyethyl)pentan-1-amine
Also Known As: S-2-((3-Cyclohexylpentyl)amino)ethyl thiosulfate|Benzolsulfonsaeure-[N-methyl-4-nitro-anilid]|2-((3-Cyclohexylpentyl)amino)ethanethiol hydrogen sulfate (ester)|Ethanethiol, 2-(3-cyclohexylpentyl)amino-, hydrogen sulfate (ester)|o-(2-{[(3s)-3-cyclohexylpentyl]amino}ethyl) hydrogen sulfurothioate|O-{2-[(3-Cyclohexylpentyl)amino]ethyl} hydrogen sulfurothioate|Thiosulfuric acid S-[2-(3-cyclohexyl-pentylamino)-ethyl] ester|(3S)-3-cyclohexyl-N-(2-hydroxysulfonothioyloxyethyl)pentan-1-amine
| Molecular Formula | C13H27NO3S2 |
|---|---|
| Molecular Weight | 309.14325 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 309.14325 |
| Monoisotopic Mass | 309.14325 |
| Heavy Atoms | 19 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 6295-75-6 |
|---|---|
| SMILES | CC[C@@H](CCNCCOS(=O)(=S)O)C1CCCCC1 |
| InChIKey | CBYIQBPWPSYNGV-LBPRGKRZSA-N |
Product Overview
Ethanethiol, 2-(3-cyclohexylpentyl)amino-, hydrogen sulfate (ester) (CAS 6295-75-6), with molecular formula C13H27NO3S2 and molecular weight 309.14325 g/mol. IUPAC: (3S)-3-cyclohexyl-N-(2-hydroxysulfonothioyloxyethyl)pentan-1-amine.
Ethanethiol, 2-(3-cyclohexylpentyl)amino-, hydrogen sulfate (ester) is a custom synthesis product. We offer services from milligram to kilogram scale.
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