Basic information
- CAS
928-88-1- Standard SMILES
CC(=O)OCCCCOCCCCOC(C)=O- InChIKey
BEGLYILTWSHMBV-UHFFFAOYSA-N- Molecular formula
- C12H22O5
- Average molar mass
- 246.3 g/mol
- Monoisotopic mass
- 246.1467238
Names & identifiers
- Preferred name
- 4,4'-Oxydibutyl diacetate
- IUPAC
- 4-(4-acetyloxybutoxy)butyl acetate
- English name
- 4,4'-oxydibutyl diacetate
- Molecular formula
- C12H22O5
- Molecular weight
- 246.3
Names & synonyms
4,4'-Oxydibutyl diacetate928-88-1EINECS 213-184-4ST9Y6H7XSB4,4'-diacetoxydibutyl etherSCHEMBL6661477DTXSID10239147BEGLYILTWSHMBV-UHFFFAOYSA-NOxydi(butane-4,1-diyl) diacetateOxybis(butane-4,1-diyl) diacetateNS000394994-(4-acetoxybutoxy)butyl acetate
Show more names
4-(4-acetyloxybutoxy)butyl acetateBisacetic acid oxybis(1,4-butanediyl)1-Butanol, 4,4'-oxybis-, diacetate (9CI)Diacetic acid 5-oxanonane-1,9-diyl ester
Database identifiers
- CAS
928-88-1- PubChem CID
- 70232
- DTXSID
DTXSID10239147- UNII
- ST9Y6H7XSB
- EC Number
- 213-184-4
- Nikkaji
- J298.503I
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 115 · 115-118 °C(Press: 0.6 Torr)
- Density
- 1.018 g/cm3 · 1.018 g/cm3(Temp: 28 °C)
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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