3-(Oxolan-2-ylmethoxy)propanenitrile
Basic information
- CAS
5338-10-3- Standard SMILES
N#CCCOCC1CCCO1- InChIKey
SXCCMCCJGSXUML-UHFFFAOYSA-N- Molecular formula
- C8H13NO2
- Average molar mass
- 155.19 g/mol
- Monoisotopic mass
- 155.09462866
Names & identifiers
- Preferred name
- 3-(Oxolan-2-ylmethoxy)propanenitrile
- IUPAC
- 3-(oxolan-2-ylmethoxy)propanenitrile
- English name
- 3-(tetrahydrofuran-2-ylmethoxy)propanenitrile
- Molecular formula
- C8H13NO2
- Molecular weight
- 155.19
Names & synonyms
3-(oxolan-2-ylmethoxy)propanenitrile5338-10-33-((Tetrahydrofurfuryl)oxy)propiononitrile3-(tetrahydrofuran-2-ylmethoxy)propanenitrile3-[(oxolan-2-yl)methoxy]propanenitrileMFCD004666103-[(Tetrahydro-2-furanyl)methoxy]propanenitrilePropanenitrile, 3-((tetrahydro-2-furanyl)methoxy)-NSC3117SCHEMBL14168843SXCCMCCJGSXUML-UHFFFAOYSA-NDTXSID101035665
Show more names
Propanenitrile, 3-[(tetrahydro-2-furanyl)methoxy]-
NSC 3117NSC-3117EINECS 226-268-0NSC404971AKOS000195658NSC 404971NSC-404971BS-28906
Database identifiers
- CAS
5338-10-3- PubChem CID
- 95351
- DTXSID
DTXSID101035665- EC Number
- 226-268-0
- Nikkaji
- J217.902D
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 42.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2932190090 · 2932190090
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
- hs_code
- 2932190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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