Ethyl glycerin acetal levulinate
Basic information
- CAS
902272-78-0- Standard SMILES
CCOC(=O)CCC1(C)OCC(CO)O1- InChIKey
JOCPGAIMQOQRNE-UHFFFAOYSA-N- Molecular formula
- C10H18O5
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.11542367
Names & identifiers
- Preferred name
- Ethyl glycerin acetal levulinate
- IUPAC
- ethyl 3-[4-(hydroxymethyl)-2-methyl-1,3-dioxolan-2-yl]propanoate
Names & synonyms
902272-78-0Ethyl glycerin acetal levulinate1,3-Dioxolane-2-propanoic acid, 4-(hydroxymethyl)-2-methyl-, ethyl ester7233JH4G65UNII-7233JH4G65DTXSID50889241ETHYL LEVULINATE PG ACETALETHYL 3-(2-HYDROXYMETHYL-5-METHYL-1,4-DIOXOLAN-5-YL)PROPIONATE1,3-DIOXOLANE-2-PROPANOIC ACID, (4-HYDROXYMETHYL)-2-METHYL, ETHYL ESTERRefChem:138937DTXCID901028505ETHYL GLYCERIN ACETAL LEVULINATE [INCI]
Show more names
Ethyl 3-[4-(hydroxymethyl)-2-methyl-1,3-dioxolan-2-yl]propanoateSCHEMBL10018598JOCPGAIMQOQRNE-UHFFFAOYSA-NQ27266014
Database identifiers
- CAS
902272-78-0- PubChem CID
- 249203
- DTXSID
DTXSID50889241- UNII
- 7233JH4G65
- EC Number
- 700-637-0
- Nikkaji
- J2.876.801J
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 31 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: Ethyl 3-[4-(hydroxymethyl)-2-methyl-1,3-dioxolan-2-yl]propanoate (EC: 700-637-0)
EPA Safer ChemicalChemical: Ethyl glycerin acetal levulinate
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Chemistry & industry
Uses & manufacturing
Household ProductsInformation on 13 consumer products that contain Ethyl levulinate glycerol ketal in the following categories is provided:
Use Classification
EPA Safer Chemical Functional Use Classes -> Solvents
Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern
General Manufacturing Information1,3-Dioxolane-2-propanoic acid, 4-(hydroxymethyl)-2-methyl-, ethyl ester: ACTIVE
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Compound notes
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