Basic information
- CAS
29915-83-1- Standard SMILES
CC1=C(C=O)CCC2(C1)OCCO2- InChIKey
NOQHSCBTBLIRGQ-UHFFFAOYSA-N- Molecular formula
- C10H14O3
- Average molar mass
- 182.22 g/mol
- Monoisotopic mass
- 182.0942943
Overview
See other relationships...
Names & identifiers
- Preferred name
- 7-Methyl-1,4-dioxaspiro[4.5]dec-7-ene-8-carbaldehyde
- IUPAC
- 7-methyl-1,4-dioxaspiro[4.5]dec-7-ene-8-carbaldehyde
- English name
- 7-Methyl-1,4-dioxaspiro(4.5)dec-7-ene-8-carboxaldehyde
- Molecular formula
- C10H14O3
- Molecular weight
- 182.22
Names & synonyms
7-Methyl-1,4-dioxaspiro[4.5]dec-7-ene-8-carbaldehyde29915-83-1DTXSID504052031,4-Dioxaspiro[4.5]dec-7-ene-8-carboxaldehyde, 7-methyl-AKOS0243394997-Methyl-1,4-dioxaspiro(4.5)dec-7-ene-8-carboxaldehyde
Database identifiers
- CAS
29915-83-1- PubChem CID
- 4645147
- DTXSID
DTXSID50405203
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- Boiling point
- 298.2 · 298.2±40.0 °C(Predicted)
- Density
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
- H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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