Basic information
- CAS
63273-80-3- Standard SMILES
Cc1ccc(OCC(O)C[NH2+]C(N)=[NH2+])cc1.O=S(=O)([O-])[O-]- InChIKey
LOPSGOAWOIAQHE-UHFFFAOYSA-N- Molecular formula
- C11H19N3O6S
- Average molar mass
- 321.35 g/mol
- Monoisotopic mass
- 321.09945651
Names & identifiers
- Preferred name
- Guanidine, (2-hydroxy-3-(4-methylphenoxy)propyl)-, sulfate (2:1) (salt), (+-)-
- IUPAC
- [amino(azaniumylidene)methyl]-[2-hydroxy-3-(4-methylphenoxy)propyl]azanium sulfate
Names & synonyms
(+-)-(2-Hydroxy-3-(4-methylphenoxy)propyl)guanidine sulfate (2:1) (salt)63273-80-3GUANIDINE, (2-HYDROXY-3-(4-METHYLPHENOXY)PROPYL)-, SULFATE (2:1) (salt), (+-)-RefChem:346742
Database identifiers
- CAS
63273-80-3- PubChem CID
- 44447
Properties
Computed structural properties
- Topological polar surface area
- 186 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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