4,7,10,13-Tetraoxahexadecanedinitrile
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Basic information
- CAS
57741-46-5- Standard SMILES
N#CCCOCCOCCOCCOCCC#N- InChIKey
KCHBZKXCYRHBDY-UHFFFAOYSA-N- Molecular formula
- C12H20N2O4
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.14230712
Names & identifiers
- Preferred name
- 4,7,10,13-Tetraoxahexadecanedinitrile
- IUPAC
- 3-[2-[2-[2-(2-cyanoethoxy)ethoxy]ethoxy]ethoxy]propanenitrile
- English name
- 4,7,10,13-tetraoxahexadecanedinitrile
- Molecular formula
- C12H20N2O4
- Molecular weight
- 256.3
Names & synonyms
57741-46-54,7,10,13-TetraoxahexadecanedinitrileEINECS 260-924-7DTXSID60206440Propanenitrile, 3,3'-(1,2-ethanediylbis(oxy-2,1-ethanediyloxy))bis-RefChem:96704DTXCID60128931260-924-74,7,10,13-tetraoxahexadecane-1,16-dinitrile3-[2-[2-[2-(2-cyanoethoxy)ethoxy]ethoxy]ethoxy]propanenitrile4,7,10,13-tetraoxa-hexadecanedinitrileMFCD00483880
Show more names
Cyano-PEG4-cyanoBis-?Cyano-?PEG4
orb3177036SCHEMBL15412364KCHBZKXCYRHBDY-UHFFFAOYSA-NAKOS022173464DS-7336DB-316009CS-0158478NS00033778
Database identifiers
- CAS
57741-46-5- PubChem CID
- 93786
- DTXSID
DTXSID60206440- EC Number
- 260-924-7
- Nikkaji
- J296.781B
Properties
Computed structural propertiesFilling in
- XLogP
- -1
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 238
Physicochemical properties
- Boiling point
- 215 °C · 215 °C(Press: 1 Torr)
- Density
- 1.0982 g/cm3 · 1.0982 g/cm3
- storage temp.
- 2 · 2-8°C
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
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