Basic information
- CAS
54305-98-5- Standard SMILES
CCCCCC(CC(OCC)OCC)OCC- InChIKey
QDAWTKVMQPNMNZ-UHFFFAOYSA-N- Molecular formula
- C14H30O3
- Average molar mass
- 246.39 g/mol
- Monoisotopic mass
- 246.21949481
Names & identifiers
- Preferred name
- Octane, 1,1,3-triethoxy-
- IUPAC
- 1,1,3-triethoxyoctane
- English name
- 1,1,3-triethoxyoctane
- Molecular formula
- C14H30O3
- Molecular weight
- 246.39
Names & synonyms
1,1,3-TriethoxyoctaneOctane, 1,1,3-triethoxy-EINECS 259-084-4DTXSID70886095RefChem:167781DTXCID401025437259-084-454305-98-5QDAWTKVMQPNMNZ-UHFFFAOYSA-NDB-311282NS00057488
Database identifiers
- CAS
54305-98-5- PubChem CID
- 108232
- DTXSID
DTXSID70886095- EC Number
- 259-084-4
- Nikkaji
- J266.857B
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 144
Physicochemical properties
- EPA Substance Registry System
- 1 · Octane, 1,1,3-triethoxy- (54305-98-5)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Octane, 1,1,3-triethoxy-
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationOctane, 1,1,3-triethoxy-: ACTIVE
Suppliers2 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
南京毕科生物科技有限公司025-58906079 17352406906 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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