Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCCCOC(=O)CC(O)(CC(=O)[O-])C(=O)[O-]- InChIKey
REVZBRXEBPWDRA-UHFFFAOYSA-L- Molecular formula
- C24H42O7-2
- Average molar mass
- 442.6 g/mol
- Monoisotopic mass
- 442.29305367
Names & identifiers
- Preferred name
- Monostearyl citrate
- IUPAC
- 2-hydroxy-2-(2-octadecoxy-2-oxoethyl)butanedioate
- English name
- STEARYL CITRATE
- Molecular weight
- 0
Names & synonyms
1337-33-31,2,3-Propanetricarboxylic acid, 2-hydroxy-, octadecyl estermonostearyl citrateMONOSTEARYL CITRATE (II)MONOSTEARYL CITRATE [II]RefChem:819373RIKESTER EW 90RIKEMAL EW 90INS NO.484INS-484DTXSID001058599E 484
Show more names
E-4841323-66-6215-654-4YWW937R1QRStearyl citrate2-hydroxy-2-(2-octadecoxy-2-oxoethyl)butanedioatestearyl monocitrate
Database identifiers
- CAS
1323-66-6、1337-33-3- PubChem CID
- 16204528
- EC Number
- 215-654-4
Properties
Computed structural properties
- XLogP
- 8.4
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 21
- Heavy atoms
- 31
- Formal charge
- -2
- Complexity
- 481
Physicochemical properties
- Indirect Additives used in Food Contact Substances
- MONOSTEARYL CITRATE
- FDA 21 CFR
- 175.3 · 175.300; 178.3910; 181.27
- FDA UNII
- 937 R1QR · YWW937R1QR
Safety & regulation
GHS classification
GHS ClassificationNot Classified；Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory Information
Chemical: 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, octadecyl ester
1,2,3-Propanetricarboxylic acid, 2-hydroxy-, octadecyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, octadecyl ester: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
Toxicology
Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
Regulatory information
Regulatory Information
Chemical: 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, octadecyl ester
1,2,3-Propanetricarboxylic acid, 2-hydroxy-, octadecyl ester: Does not have an individual approval but may be used under an appropriate group standard
Chemistry & industry
Uses & manufacturing
UsesCIR ingredient: Stearyl Citrate
Use Classification
Food Additives -> EMULSIFIER; SEQUESTRANT -> JECFA Functional Classes
Cosmetics -> Emollient; Skin conditioning
General Manufacturing Information1,2,3-Propanetricarboxylic acid, 2-hydroxy-, octadecyl ester: ACTIVE
Suppliers3 total
郑州九亿时光新材料有限公司+86-15225627621 +86-13213167925 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
溧阳市瑞普新材料有限公司0519-18951201333 18951201333 · [email protected]
Related reactions
1 records
Linked notes
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