Guanidine, N-(2-(hexahydro-4-methyl-1H-azepin-1-yl)ethyl)-, sulfate (1:?)
Basic information
- CAS
2948-77-8- Standard SMILES
CC1CCCN(CCN=C(N)N)CC1.O=S(=O)(O)O- InChIKey
ZYZVLXPDNXKWPT-UHFFFAOYSA-N- Molecular formula
- C10H24N4O4S
- Average molar mass
- 296.39 g/mol
- Monoisotopic mass
- 296.15182643
Names & identifiers
- Preferred name
- Guanidine, N-(2-(hexahydro-4-methyl-1H-azepin-1-yl)ethyl)-, sulfate (1:?)
- IUPAC
- 2-[2-(4-methylazepan-1-yl)ethyl]guanidine;sulfuric acid
Names & synonyms
2948-77-8RefChem:1086279Guanidine, N-(2-(hexahydro-4-methyl-1H-azepin-1-yl)ethyl)-, sulfate (1:?)(2-(4-Methylhexahydro-1H-azepin-1-yl)ethyl)guanidine sulfate(2-(Hexahydro-4-methyl-1H-azepin-1-yl)ethyl)guanidine sulfateGuanidine, (2-(hexahydro-4-methyl-1H-azepin-1-yl)ethyl)-, sulfate1-(2-(4-Methylazepan-1-yl)ethyl)guanidine xsulfateDTXSID00951987Sulfuric acid--N-[2-(4-methylazepan-1-yl)ethyl]guanidine (1/1)
Database identifiers
- CAS
2948-77-8- PubChem CID
- 200937
- DTXSID
DTXSID00951987
Properties
Computed structural properties
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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