(Methylazanediyl)di(ethane-2,1-diyl) bis(hydrogen butylcarbonimidate)--hydrogen chloride (1/1)
Basic information
- CAS
27475-01-0- Standard SMILES
CCCCNC(=O)OCC[NH+](C)CCOC(=O)NCCCC.[Cl-]- InChIKey
WKZMRVBQCUEKPJ-UHFFFAOYSA-N- Molecular formula
- C15H32ClN3O4
- Average molar mass
- 353.88 g/mol
- Monoisotopic mass
- 353.2081342
Names & identifiers
- Preferred name
- (Methylazanediyl)di(ethane-2,1-diyl) bis(hydrogen butylcarbonimidate)--hydrogen chloride (1/1)
- IUPAC
- bis[2-(butylcarbamoyloxy)ethyl]-methylazanium chloride
Names & synonyms
27475-01-0DTXSID40950171(Methylazanediyl)di(ethane-2,1-diyl) bis(hydrogen butylcarbonimidate)--hydrogen chloride (1/1)RefChem:1050984DTXCID201378337CARBAMIC ACID, BUTYL-, DIESTER with (METHYLIMINO)DIETHANOL, HYDROCHLORIDEEthanol, 2,2'-(methylimino)di-, bis(butylcarbamate), hydrochloride
Database identifiers
- CAS
27475-01-0- PubChem CID
- 33911
Properties
Computed structural properties
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 273
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Compound notes
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