1,4-Cyclohexanebis(methylamine), N,N'-bis(2-hydroxybenzyl)-, diacetate
Basic information
- CAS
2667-70-1- Standard SMILES
CC(=O)O.CC(=O)O.Oc1ccccc1CNCC1CCC(CNCc2ccccc2O)CC1- InChIKey
VWRXSXTYPJLXGI-UHFFFAOYSA-N- Molecular formula
- C26H38N2O6
- Average molar mass
- 474.6 g/mol
- Monoisotopic mass
- 474.27298694
Names & identifiers
- Preferred name
- 1,4-Cyclohexanebis(methylamine), N,N'-bis(2-hydroxybenzyl)-, diacetate
- IUPAC
- acetic acid;2-[[[4-[[(2-hydroxyphenyl)methylamino]methyl]cyclohexyl]methylamino]methyl]phenol
Names & synonyms
1,4-Cyclohexanebis(methylamine), N,N'-bis(2-hydroxybenzyl)-, diacetateN,N'-Bis(2-hydroxybenzyl)-1,4-cyclohexanebis(methylamine) diacetate2667-70-1DTXSID30181194Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(2-hydroxy-, diacetateN,N'-(1,4-Cyclohexylenedimethylene)bis(2-hydroxybenzylamine) diacetateRefChem:220316DTXCID40103685Acetic acid--2,2'-[cyclohexane-1,4-diylbis(methyleneazanediylmethylene)]diphenol (2/1)
Database identifiers
- CAS
2667-70-1- PubChem CID
- 102309
- DTXSID
DTXSID30181194
Properties
Computed structural properties
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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