Basic information
- CAS
42018-32-6- Standard SMILES
CC(=O)c1ccc(OCC(=O)N2CCCC2)cc1- InChIKey
GGYYBRCVBOHZBD-UHFFFAOYSA-N- Molecular formula
- C14H17NO3
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.1208434
Names & identifiers
- Preferred name
- Acetophenone, 4'-pyrrolidinylcarbonylmethoxy-
- IUPAC
- 2-(4-acetylphenoxy)-1-pyrrolidin-1-ylethanone
- English name
- 4'-[(1-Pyrrolidinyl)carbonylmethoxy]acetophenone
- Molecular weight
- 0
Names & synonyms
42018-32-6ACETOPHENONE, 4'-PYRROLIDINYLCARBONYLMETHOXY-4'-PyrrolidinylcarbonylmethoxyacetophenoneDTXSID70194829RefChem:316972DTXCID601173202-(4-acetylphenoxy)-1-(pyrrolidin-1-yl)ethanone2-(4-acetylphenoxy)-1-(pyrrolidin-1-yl)ethan-1-one1-[4-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]ethanone2-(4-acetylphenoxy)-1-pyrrolidin-1-ylethanone4'-[(1-Pyrrolidinyl)carbonylmethoxy]acetophenoneMFCD01673208
Show more names
2-(4-Acetylphenoxy)-1-(1-pyrrolidinyl)ethanone
SCHEMBL335348GGYYBRCVBOHZBD-UHFFFAOYSA-NSBA01832AKOS000203236EN300-07248G32108SR-01000045835SR-01000045835-1
Database identifiers
- CAS
42018-32-6- PubChem CID
- 39088
- DTXSID
DTXSID70194829- EC Number
- 192-553-0
- Nikkaji
- J90.784G
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 302
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-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
- P280-P305+P351+P338
Chemistry & industry
Suppliers1 total
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
2 records
Compound notes
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