Butanedioic acid, 2-methylene-, 1,4-bis(2-hydroxypropyl) ester
Basic information
- CAS
13824-30-1- Standard SMILES
C=C(CC(=O)OCC(C)O)C(=O)OCC(C)O- InChIKey
QOLRMRIVONNWSS-UHFFFAOYSA-N- Molecular formula
- C11H18O6
- Average molar mass
- 246.26 g/mol
- Monoisotopic mass
- 246.11033829
Names & identifiers
- Preferred name
- Butanedioic acid, 2-methylene-, 1,4-bis(2-hydroxypropyl) ester
- IUPAC
- bis(2-hydroxypropyl) 2-methylidenebutanedioate
- English name
- bis(2-hydroxypropyl) methylenesuccinate
- Molecular formula
- C11H18O6
- Molecular weight
- 246.25702
Names & synonyms
Bis(2-hydroxypropyl) methylenesuccinate13824-30-1Di-2-hydroxypropyl itaconateEINECS 237-518-3Butanedioic acid, methylene-, bis(2-hydroxypropyl) esterButanedioic acid, 2-methylene-, 1,4-bis(2-hydroxypropyl) esterDTXSID50884650RefChem:570895DTXCID101024080237-518-3bis(2-hydroxypropyl) 2-methylidenebutanedioateEINECS 258-257-1
Show more names
2-Methylenebutanedioic acid bis(2-hydroxypropyl) ester
SCHEMBL822257QOLRMRIVONNWSS-UHFFFAOYSA-N2-Methylenesuccinic acid, ester with propane-1,2-diol (1:2)52919-42-3NS00052258
Database identifiers
- CAS
13824-30-1、52919-42-3- PubChem CID
- 103703
- DTXSID
DTXSID50884650- EC Number
- 237-518-3、258-257-1
- Nikkaji
- J280.321F
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 93.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- EPA Substance Registry System
- Butanedioic acid, methylene-, bis(2-hydroxypropyl) ester (13824-30-1)
- TSCA
- TSCA listed
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 ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationButanedioic acid, 2-methylene-, 1,4-bis(2-hydroxypropyl) ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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