Basic information
- CAS
53219-90-2- Standard SMILES
O=C(CCBr)OCCCCCOC(=O)CCBr- InChIKey
XFUTVHAXMLALRL-UHFFFAOYSA-N- Molecular formula
- C11H18Br2O4
- Average molar mass
- 374.07 g/mol
- Monoisotopic mass
- 371.95718
Names & identifiers
- Preferred name
- Pentane-1,5-diyl bis(3-bromopropionate)
- IUPAC
- 5-(3-bromopropanoyloxy)pentyl 3-bromopropanoate
- English name
- pentane-1,5-diyl bis(3-bromopropionate)
- Molecular formula
- C11H18Br2O4
- Molecular weight
- 374.07
Names & synonyms
Pentane-1,5-diyl bis(3-bromopropionate)53219-90-2EINECS 258-433-8pentane-1,5-diyl bis(3-bromopropanoate)DTXSID10201304XFUTVHAXMLALRL-UHFFFAOYSA-NDB-255930NS00032682Bis(3-bromopropionic acid)1,5-pentanediylPropanoic acid, 3-bromo-, 1,5-pentanediyl ester (9CI)
Database identifiers
- CAS
53219-90-2- PubChem CID
- 104445
- DTXSID
DTXSID10201304- EC Number
- 258-433-8
- Nikkaji
- J295.909G
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 200
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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