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1,1',1''-(1,2,3-Propanetriyl) tris(2-hydroxypropanoate)

HCID 102429
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
537-32-6
Standard SMILES
CC(O)C(=O)OCC(COC(=O)C(C)O)OC(=O)C(C)O
InChIKey
QFZKSWMAYXNSEJ-UHFFFAOYSA-N
Molecular formula
C12H20O9
Average molar mass
308.28 g/mol
Monoisotopic mass
308.11073221

Names & identifiers

Preferred name
1,1',1''-(1,2,3-Propanetriyl) tris(2-hydroxypropanoate)
IUPAC
2,3-bis(2-hydroxypropanoyloxy)propyl 2-hydroxypropanoate
English name
propane-1,2,3-triyl trilactate
Molecular formula
C12H20O9
Molecular weight
308.28

Names & synonyms

Trilactin537-32-69ATF4982XBPELEMOL GTLRefChem:10514671,1',1''-(1,2,3-Propanetriyl) tris(2-hydroxypropanoate)208-664-5Propane-1,2,3-triyl trilactate2,3-bis(2-hydroxypropanoyloxy)propyl 2-hydroxypropanoatepropane-1,2,3-triyl tris(2-hydroxypropanoate)EINECS 208-664-5UNII-9ATF4982XB
Show more names
Tris(2-hydroxypropanoic acid)1,2,3-propanetriyl ester1,3-bis(2-hydroxypropanoyloxy)propan-2-yl 2-hydroxypropanoatePropanoic acid, 2-hydroxy-, 1,1',1''-(1,2,3-propanetriyl) ester2-hydroxypropionic acid [2-lactoyloxy-1-(lactoyloxymethyl)ethyl] ester
GLYCERYL TRILACTATEGLYCEROL, TRILACTATESCHEMBL29384224QFZKSWMAYXNSEJ-UHFFFAOYSA-NNS00014176LACTIC ACID, 1,2,3-PROPANETRIYL ESTERQ27272284PROPANOIC ACID, 2-HYDROXY-, 1,2,3-PROPANETRIYL ESTER

Database identifiers

CAS
537-32-6

Properties

Computed structural properties

XLogP
-0.8
Topological polar surface area
140 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
9
Rotatable bonds
11
Heavy atoms
21
Formal charge
0
Complexity
344

Experimental & physicochemical properties

CosmeticsHumectant; Moisturising

Physicochemical properties

Boiling point
395.5 · 395.5±37.0 °C(Predicted)
Density
1.334 · 1.334±0.06 g/cm3(Predicted)
pka
12.59 · 12.59±0.20(Predicted)
Cosmetics Ingredients Functions
MOISTURISINGHUMECTANTSKIN CONDITIONING
EWG's Food Scores
1 · 1
FDA UNII
9 ATF4982XB · 9ATF4982XB

Chemistry & industry

Uses & manufacturing

Use ClassificationCosmetics -> Humectant; Moisturising

Suppliers4 total

陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
PubChem CID
102429
DTXSID
DTXSID00939664
UNII
9ATF4982XB
EC Number
208-664-5
Nikkaji
J188.383F