6-ethoxy-2,3-dihydro-1H-indene-5-carbaldehyde
Basic information
- CAS
876717-50-9- Standard SMILES
CCOc1cc2c(cc1C=O)CCC2- InChIKey
DGWSPLWUFBLCPY-UHFFFAOYSA-N- Molecular formula
- C12H14O2
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.09937969
Names & identifiers
- Preferred name
- 6-ethoxy-2,3-dihydro-1H-indene-5-carbaldehyde
- IUPAC
- 6-ethoxy-2,3-dihydro-1H-indene-5-carbaldehyde
- English name
- 6-ethoxyindane-5-carbaldehyde(SALTDATA: FREE)
- Molecular formula
- C12H14O2
- Molecular weight
- 190.24
Names & synonyms
876717-50-96-ethoxy-2,3-dihydro-1H-indene-5-carbaldehyde6-ETHOXY-5-INDANECARBALDEHYDE6-ethoxyindane-5-carbaldehydeMFCD06247351DTXSID60390237BBL025923SBB010831STL367223AKOS000346039VS-08153CS-0151501
Show more names
ST50289605E760346-ethoxyindane-5-carbaldehyde(SALTDATA: FREE)F3094821H-Indene-5-carboxaldehyde, 6-ethoxy-2,3-dihydro-
Database identifiers
- CAS
876717-50-9- PubChem CID
- 3159686
- DTXSID
DTXSID60390237
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- Boiling point
- 330.8 · 330.8±42.0 °C(Predicted)
- Density
- 1.114 · 1.114±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 233 · P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
- HS Code
- 2912490090 · 2912490090
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
- 2912490090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
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Related reactions
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Compound notes
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