Basic information
- CAS
3634-95-5- Standard SMILES
CCCCCCOC(=O)CCCC(=O)OCCCCCC- InChIKey
GXFXLHQQYQDXKC-UHFFFAOYSA-N- Molecular formula
- C17H32O4
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.2300595
Names & identifiers
- Preferred name
- Dihexyl glutarate
- IUPAC
- dihexyl pentanedioate
- English name
- dihexyl glutarate
- Molecular formula
- C17H32O4
- Molecular weight
- 300.43
Names & synonyms
Dihexyl glutarate3634-95-5dihexyl pentanedioateEINECS 222-857-1SCHEMBL491706Pentanedioic acid, dihexyl esterDTXSID10189875NS00030024Pentanedioic acid dihexyl esterPentanedioic acid, 1,5-dihexyl ester
Database identifiers
- CAS
3634-95-5- PubChem CID
- 77192
- DTXSID
DTXSID10189875- EC Number
- 222-857-1
- Nikkaji
- J205.557K
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 16
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 238
Chemistry & industry
Suppliers1 total
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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