Basic information
- CAS
53966-56-6- Standard SMILES
C#CC(CC)(CC)OCC- InChIKey
UJUPEHRSFQFPLK-UHFFFAOYSA-N- Molecular formula
- C9H16O
- Average molar mass
- 140.22 g/mol
- Monoisotopic mass
- 140.12011513
Names & identifiers
- Preferred name
- 3-Ethoxy-3-ethylpent-1-yne
- IUPAC
- 3-ethoxy-3-ethylpent-1-yne
- English name
- 3-Ethoxy-3-ethyl-1-pentyne
- Molecular formula
- C9H16O
- Molecular weight
- 140.22
Names & synonyms
3-ethoxy-3-ethylpent-1-yneRefChem:501150833-930-81-Pentyne, 3-ethoxy-3-ethyl-53966-56-63-Ethoxy-3-ethyl-1-pentyneSCHEMBL26113252DTXSID60339742UJUPEHRSFQFPLK-UHFFFAOYSA-N1,1-Diethyl-2-propynyl ethyl ether #DB-366428EN300-1722188
Database identifiers
- CAS
53966-56-6- PubChem CID
- 558202
- DTXSID
DTXSID60339742- EC Number
- 833-930-8
- Nikkaji
- J110.537J
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS02
- Signal word
- Warning
- Hazard statements
- 226 · H226-H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS02
- Hazard statements
- H226-H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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