3-((2-Hydroxydodecyl)methylamino)propane-1,2-diol
Basic information
- CAS
60659-36-1- Standard SMILES
CCCCCCCCCCC(O)CN(C)CC(O)CO- InChIKey
PFGDHGPYLSLZQD-UHFFFAOYSA-N- Molecular formula
- C16H35NO3
- Average molar mass
- 289.45 g/mol
- Monoisotopic mass
- 289.26169398
Names & identifiers
- Preferred name
- 3-((2-Hydroxydodecyl)methylamino)propane-1,2-diol
- IUPAC
- 3-[2-hydroxydodecyl(methyl)amino]propane-1,2-diol
- English name
- 3-[(2-hydroxydodecyl)methylamino]propane-1,2-diol
- Molecular formula
- C16H35NO3
- Molecular weight
- 289.45
Names & synonyms
60659-36-13-((2-Hydroxydodecyl)methylamino)propane-1,2-diol3-[(2-HYDROXYDODECYL)METHYLAMINO]PROPANE-1,2-DIOLEINECS 262-350-2SCHEMBL11404928DTXSID30976087PFGDHGPYLSLZQD-UHFFFAOYSA-N3-[(2-HYDROXYDODECYL)(METHYL)AMINO]PROPANE-1,2-DIOLDB-293987NS000543051,2-Propanediol, 3-[(2-hydroxydodecyl)methylamino]-3-[(2-Hydroxydodecyl)(methyl)amino]-1,2-propanediol
Database identifiers
- CAS
60659-36-1- PubChem CID
- 108487
- DTXSID
DTXSID30976087- EC Number
- 262-350-2
- Nikkaji
- J268.249D
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 202
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Compound notes
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