Guanidine, (2-(N-methylanilino)ethyl)-, sulfate (2:1)

HCID 202255

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Basic information

CAS: 10030-29-2
Standard SMILES: CN(CCN=C(N)N)c1ccccc1.CN(CCN=C(N)N)c1ccccc1.O=S(=O)(O)O
InChIKey: WHKNGCJEOHTVLU-UHFFFAOYSA-N
Molecular formula: C20H34N8O4S
Average molar mass: 482.6 g/mol
Monoisotopic mass: 482.24237277

Names & identifiers

Preferred name: Guanidine, (2-(N-methylanilino)ethyl)-, sulfate (2:1)
IUPAC: bis(2-[2-(N-methylanilino)ethyl]guanidine);sulfuric acid

Names & synonyms

(2-(N-Methylanilino)ethyl)guanidine hemisulfateGuanidine, (2-(N-methylanilino)ethyl)-, sulfate (2:1)(2-(N-Methyl-N-phenylamino)ethyl)guanidine hemisulfate10030-29-2DTXSID00143123RefChem:346719DTXCID8065614Sulfuric acid--N''-{2-[methyl(phenyl)amino]ethyl}guanidine (1/2)

Database identifiers

CAS: 10030-29-2
PubChem CID: 202255
DTXSID: DTXSID00143123

Properties

Computed structural properties

Topological polar surface area: 218 Å²
Hydrogen bond donors: 6
Hydrogen bond acceptors: 8
Rotatable bonds: 8
Heavy atoms: 33
Formal charge: 0
Complexity: 262

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