Decanedioic acid, 2-butoxyethyl ester
Basic information
- CAS
68186-66-3- Standard SMILES
CCCCOCCOC(=O)CCCCCCCCC(=O)O- InChIKey
ZGCXNQBDICMZNA-UHFFFAOYSA-N- Molecular formula
- C16H30O5
- Average molar mass
- 302.41 g/mol
- Monoisotopic mass
- 302.20932405
Names & identifiers
- Preferred name
- Decanedioic acid, 2-butoxyethyl ester
- IUPAC
- 10-(2-butoxyethoxy)-10-oxodecanoic acid
Names & synonyms
Decanedioic acid, 2-butoxyethyl ester68186-66-3DTXSID50887227RefChem:131186DTXCID50102653310-(2-butoxyethoxy)-10-oxodecanoic acidSCHEMBL11209246
Database identifiers
- CAS
68186-66-3- PubChem CID
- 109692
- DTXSID
DTXSID50887227- Nikkaji
- J1.556.527F
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 16
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 265
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationDecanedioic acid, 2-butoxyethyl ester: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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