Dipropyl oxalate
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Basic information
- CAS
615-98-5- Standard SMILES
CCCOC(=O)C(=O)OCCC- InChIKey
HZHMMLIMOUNKCK-UHFFFAOYSA-N- Molecular formula
- C8H14O4
- Average molar mass
- 174.19 g/mol
- Monoisotopic mass
- 174.08920892
Names & identifiers
- Preferred name
- Dipropyl oxalate
- IUPAC
- dipropyl oxalate
- English name
- DI-N-PROPYL OXALATE
- Molecular formula
- C8H14O4
- Molecular weight
- 174.19
Names & synonyms
Dipropyl oxalate615-98-5di-n-Propyl oxalateOxalic acid, dipropyl esterUNII-R75L3I7DOHR75L3I7DOHEthanedioic acid, dipropyl esterNSC-4878EINECS 210-456-4AI3-32501DTXSID00210480NSC 4878
Show more names
dipropyloxalaten-Propyl oxalatedipropyl ethanedioateoxalicaciddipropylester(1R,3S)-3-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]-1-cyclohexanecarboxylic acid
ETHANEDIOIC ACID, 1,2-DIPROPYL ESTERRefChem:134844DIPROPYL OXALATE [INCI]DTXCID00132971210-456-4HZHMMLIMOUNKCK-UHFFFAOYSA-Noxalic acid dipropyl esterdipropyl ethane-1,2-dioate
Database identifiers
- CAS
615-98-5- PubChem CID
- 69214
- DTXSID
DTXSID00210480- UNII
- R75L3I7DOH
- EC Number
- 210-456-4
- Nikkaji
- J43.452C
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 135
Experimental & physicochemical properties
CosmeticsChelating
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -44.3 °C · -44.3°C
- Boiling point
- 211 °C · 211°C (estimate)
- Density
- 1.0188 · 1.0188
- refractive index
- 1.4158 · 1.4158 (estimate)
- Odor
- RoseHoney type odor.
- Cosmetics Ingredients Functions
- CHELATINGSOLVENTPLASTICISER
- LogP
- 1.723 · 1.723 (est)
- FDA UNII
- 75 L3I7DOH · R75L3I7DOH
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
Chemistry & industry
Uses & manufacturing
Use ClassificationCosmetics -> Chelating
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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