Basic information
- CAS
7504-58-7- Standard SMILES
COc1ccc(C(=O)N2CCOCC2)cc1- InChIKey
NQXDFSXYFLBDHX-UHFFFAOYSA-N- Molecular formula
- C12H15NO3
- Average molar mass
- 221.25 g/mol
- Monoisotopic mass
- 221.10519334
Names & identifiers
- Preferred name
- 4-(4-Methoxybenzoyl)morpholine
- IUPAC
- (4-methoxyphenyl)-morpholin-4-ylmethanone
- English name
- Morpholino(4-methoxyphenyl) ketone
- Molecular formula
- C12H15NO3
- Molecular weight
- 221.25
Names & synonyms
Morpholine, 4-(4-methoxybenzoyl)-Morpholine, 4-(p-methoxybenzoyl)-4-(4-methoxybenzoyl)morpholine7504-58-7CCH6F4QD52NSC-407868DTXSID80226004RefChem:1069968DTXCID40148495(4-methoxyphenyl)(morpholin-4-yl)methanonep-Anisic acid, morpholide(4-methoxyphenyl)(morpholino)methanone
Show more names
Morpholino(4-methoxyphenyl) ketoneMethanone, (4-methoxyphenyl)-4-morpholinyl-
N-(4-METHOXYBENZOYL)MORPHOLINE4-(p-Methoxybenzoyl)morpholineNSC 407868BRN 1214017AI3-22703NSC407868UNII-CCH6F4QD52SCHEMBL9792247
Database identifiers
- CAS
7504-58-7- PubChem CID
- 82013
- DTXSID
DTXSID80226004- UNII
- CCH6F4QD52
- Nikkaji
- J42.345I
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 230
Physicochemical properties
- Boiling point
- 392.7 · 392.7±37.0 °C(Predicted)
- Density
- 1.167 · 1.167±0.06 g/cm3(Predicted)
- pka
- -1.11 · -1.11±0.20(Predicted)
- FDA UNII
- 6 F4QD52 · CCH6F4QD52
- 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
Suppliers2 total
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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