Basic information
- CAS
19835-69-9- Standard SMILES
O=CC1CCC=CCCC1- InChIKey
MVQUNYFSOGSFLD-UHFFFAOYSA-N- Molecular formula
- C9H14O
- Average molar mass
- 138.21 g/mol
- Monoisotopic mass
- 138.10446507
Overview
See also: 4-Cyclooctene-1-carboxyldehyde (annotation moved to).
Names & identifiers
- Preferred name
- 4-Cyclooctene-1-carboxaldehyde
- IUPAC
- cyclooct-4-ene-1-carbaldehyde
- English name
- 4-Cycloocten-1-carboxaldehyd
- Molecular formula
- C9H14O
- Molecular weight
- 138.21
Names & synonyms
19835-69-9cyclooct-4-ene-1-carbaldehyde4-Cyclooctene-1-carboxaldehyde4-Cycloocten-1-carboxaldehydSCHEMBL1230434DTXSID60336938MVQUNYFSOGSFLD-UHFFFAOYSA-N
Database identifiers
- CAS
19835-69-9- PubChem CID
- 537409
- DTXSID
DTXSID60336938
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 127
Physicochemical properties
- Boiling point
- 58 °C · 58 °C(Press: 1 Torr)
- Density
- 0.974 · 0.974±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
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
- H317
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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