Basic information
- CAS
102571-39-1- Standard SMILES
CCCCCCCCCCC[N+](CCO)(CCO)Cc1ccccc1.[Cl-]- InChIKey
ZUFVHPNINAHAMF-UHFFFAOYSA-M- Molecular formula
- C22H40ClNO2
- Average molar mass
- 386 g/mol
- Monoisotopic mass
- 385.2747572
Names & identifiers
- Preferred name
- Benzenemethanaminium, N,N-bis(2-hydroxyethyl)-N-undecyl-, chloride (1:1)
- IUPAC
- benzyl-bis(2-hydroxyethyl)-undecylazanium chloride
- English name
- Di(2-hydroxyethyl)benzylundecylammonium chloride
- Molecular formula
- C22H40ClNO2
- Molecular weight
- 386.0115
Names & synonyms
102571-39-1Benzenemethanaminium, N,N-bis(2-hydroxyethyl)-N-undecyl-, chloride (1:1)RefChem:1078509600-325-3Di(2-hydroxyethyl)benzylundecylammonium chlorideDTXSID90907756n-benzyl-n,n-bis(2-hydroxyethyl)undecan-1-aminium chlorideAMMONIUM, BENZYLBIS(2-HYDROXYETHYL)UNDECYL-, CHLORIDE
Database identifiers
- CAS
102571-39-1- PubChem CID
- 59530
- DTXSID
DTXSID90907756- EC Number
- 600-325-3
Properties
Computed structural properties
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 284
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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