Basic information
- CAS
7396-21-6- Standard SMILES
CC(=O)c1cccc2cc3ccccc3cc12- InChIKey
MGRRZBKEFOXFRI-UHFFFAOYSA-N- Molecular formula
- C16H12O
- Average molar mass
- 220.26 g/mol
- Monoisotopic mass
- 220.088815
Names & identifiers
- Preferred name
- 1-(Anthracen-1-yl)ethanone
- IUPAC
- 1-anthracen-1-ylethanone
- English name
- 1-(anthracen-1-yl)ethanone
- Molecular formula
- C16H12O
- Molecular weight
- 220.27
Names & synonyms
1-(Anthracen-1-yl)ethanone7396-21-61-anthracen-1-ylethanone1-(ANTHRACEN-1-YL)ETHAN-1-ONEMFCD001836691-ANTHRACEN-1-YL-ETHANONEacetylanthraceneNSC4074961-(1-anthryl)ethanoneSCHEMBL978940SCHEMBL76100031-ANTHRYL METHYL KETONE
Show more names
Ethanone, 1-(1-anthracenyl)-
SCHEMBL29875368DTXSID70324669CS-M1120AKOS016012034NSC-407496CS-13292DB-311182F789023
Database identifiers
- CAS
7396-21-6- PubChem CID
- 348256
- DTXSID
DTXSID70324669- Nikkaji
- J354.620I
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- Melting point
- 103 · 103-105 °C
- Boiling point
- 405.9 · 405.9±14.0 °C(Predicted)
- Density
- 1.164 · 1.164±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
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
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers9 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
上海皓元医药股份有限公司021-58950125 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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