Basic information
- CAS
37593-05-8- Standard SMILES
CCCCCCCCCc1ccc(C(C)=O)cc1- InChIKey
PWRSUUUQEQAMEV-UHFFFAOYSA-N- Molecular formula
- C17H26O
- Average molar mass
- 246.4 g/mol
- Monoisotopic mass
- 246.19836545
Names & identifiers
- Preferred name
- p-Nonylacetophenone
- IUPAC
- 1-(4-nonylphenyl)ethanone
- English name
- 4-n-Nonylacetophenone
- Molecular formula
- C17H26O
- Molecular weight
- 246.39
Names & synonyms
37593-05-8p-Nonylacetophenone4-n-Nonylacetophenone1-(4-nonylphenyl)ethanone1-(4-nonylphenyl)ethan-1-onep-nonyl acetophenone4'-n-nonylacetophenone1-acetyl-4-nonylbenzeneSCHEMBL962497DTXSID60191029PWRSUUUQEQAMEV-UHFFFAOYSA-NMFCD00043717
Show more names
Ethanone, 1-(4-nonylphenyl)-1-phenyl-3-propyl-1-octanone
AKOS024348934DB-049144CS-0363607ST50826768
Database identifiers
- CAS
37593-05-8- PubChem CID
- 142175
- DTXSID
DTXSID60191029
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 214
Physicochemical properties
- Boiling point
- 159 °C · 159 °C
- refractive index
- 1.505 · 1.5050
- Flash point
- 159 · 159-161°C/2mm
- Specific Gravity
- 0.935 · 0.935
- CAS DataBase Reference
- 37593 · 37593-05-8(CAS DataBase Reference)
Chemistry & industry
Suppliers10 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
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Related reactions
2 records
Compound notes
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