Basic information
- CAS
817-01-6- Standard SMILES
CCCCCCCCCCCCN(CC(O)CO)CC(O)CO- InChIKey
MVKAHJLPJBMCFN-UHFFFAOYSA-N- Molecular formula
- C18H39NO4
- Average molar mass
- 333.5 g/mol
- Monoisotopic mass
- 333.28790873
Names & identifiers
- Preferred name
- 3,3'-(Dodecylimino)bis(1,2-propanediol)
- IUPAC
- 3-[2,3-dihydroxypropyl(dodecyl)amino]propane-1,2-diol
- English name
- 3,3'-(dodecylimino)bispropane-1,2-diol
- Molecular formula
- C18H39NO4
- Molecular weight
- 333.51
Names & synonyms
3,3'-(Dodecylimino)bispropane-1,2-diol817-01-6608730Q9OBRefChem:10655323,3'-(Dodecylimino)bis(1,2-propanediol)212-441-83-[2,3-dihydroxypropyl(dodecyl)amino]propane-1,2-diol3,3'-(dodecylimino)dipropane-1,2-diol3,3'-(Dodecylazanediyl)bis(propane-1,2-diol)EINECS 212-441-8UNII-608730Q9OBSCHEMBL11416016
Show more names
LAURIMINO BISPROPANEDIOLDodecylbis(2,3-dihydroxypropyl)amine
MVKAHJLPJBMCFN-UHFFFAOYSA-NDTXSID2010021301,2-Propanediol, 3,3'-(dodecylimino)bis-NS000419143,3'-(Dodecylazanediyl)di(propane-1,2-diol)N,N-BIS(2,3-DIHYDROXYPROPYL)LAURYLAMINE1,2-PROPANEDIOL, 3,3'-(DODECYLIMINO)DI-N,N-BIS(2,3-DIHYDROXYPROPYL)-N-DODECYLAMINE
Database identifiers
- CAS
817-01-6- PubChem CID
- 102492
- DTXSID
DTXSID201002130- UNII
- 608730Q9OB
- EC Number
- 212-441-8
- Nikkaji
- J193.206C
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 17
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Boiling point
- 24.5 · 24.5-24.8 °C(Press: 0.35 Torr)
- Density
- 1.03 · 1.030±0.06 g/cm3(Predicted)
- pka
- 13.68 · 13.68±0.20(Predicted)
- Cosmetics Ingredients Functions
- CLEANSINGSURFACTANT - EMULSIFYINGSURFACTANT - CLEANSING
- LogP
- 4.635 · 4.635 (est)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 608730 Q9OB · 608730Q9OB
Chemistry & industry
Suppliers1 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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