3-Cyclohexene-1-propanal
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Basic information
- CAS
22858-74-8- Standard SMILES
O=CCCC1CC=CCC1- InChIKey
OXUBYKXQGDQVQR-UHFFFAOYSA-N- Molecular formula
- C9H14O
- Average molar mass
- 138.21 g/mol
- Monoisotopic mass
- 138.10446507
Names & identifiers
- Preferred name
- 3-Cyclohexene-1-propanal
- IUPAC
- 3-cyclohex-3-en-1-ylpropanal
- English name
- 3-(3-Cyclohexenyl)propanal
- Molecular formula
- C9H14O
- Molecular weight
- 138.21
Names & synonyms
3-Cyclohexene-1-propanal22858-74-83-(3-Cyclohexenyl)propanalDTXSID80885216RefChem:93593DTXCID901024610OXUBYKXQGDQVQR-UHFFFAOYSA-N3-(cyclohex-3-en-1-yl)propanal3-cyclohex-3-en-1-ylpropanalSCHEMBL5270209SCHEMBL148406173-(3-Cyclohexen-1-yl)propanal #
Show more names
3-(1-cyclohex-3-enyl)-propionaldehydeEN300-1857724Z1511746907
Database identifiers
- CAS
22858-74-8- PubChem CID
- 90847
- DTXSID
DTXSID80885216- EC Number
- 985-000-7
- Nikkaji
- J422.104D
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 127
Physicochemical properties
- EPA Substance Registry System
- 3 · 3-Cyclohexene-1-propanal (22858-74-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3-Cyclohexene-1-propanal: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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