Basic information
- CAS
21970-65-0- Standard SMILES
CN(CCC(=O)c1ccccc1)Cc1ccccc1- InChIKey
LNCWFHRJTAQGBG-UHFFFAOYSA-N- Molecular formula
- C17H19NO
- Average molar mass
- 253.34 g/mol
- Monoisotopic mass
- 253.14666423
Names & identifiers
- Preferred name
- 3-[Benzyl(methyl)amino]-1-phenylpropan-1-one
- IUPAC
- 3-[benzyl(methyl)amino]-1-phenylpropan-1-one
- English name
- 1-Propanone, 3-[methyl(phenylmethyl)amino]-1-phenyl-
- Molecular formula
- C17H19NO
- Molecular weight
- 253.34
Names & synonyms
21970-65-03-[benzyl(methyl)amino]-1-phenylpropan-1-one3-(Benzyl(methyl)amino)-1-phenylpropan-1-onebeta-N-Benzyl-N'-methylaminopropiophenoneMFCD17103238Fluoxetine Impurity 27b-N-Benzyl-N'-methylaminopropiophenone3-[Methyl(phenylmethyl)amino]-1-phenyl-1-propanone1-Propanone, 3-[methyl(phenylmethyl)amino]-1-phenyl-YLA9JX4LKRSCHEMBL6338596DTXSID40275775
Show more names
β-N-Benzyl-N'-methylaminopropiophenone
EBC-53034AKOS011905796atomoxetine hydrochloride impurity SM1-3BS-45854IB158700SY549943DB-098996CS-0199034
Database identifiers
- CAS
21970-65-0- PubChem CID
- 79422
- DTXSID
DTXSID40275775- UNII
- YLA9JX4LKR
- EC Number
- 606-868-2
- Nikkaji
- J646.610I
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Melting point
- 187 · 187-188 °C
- Boiling point
- 374.2 · 374.2±25.0 °C(Predicted)
- Density
- 1.062 · 1.062±0.06 g/cm3(Predicted)
- storage temp.
- Refrigerator, Under inert atmosphere
- solubility
- Chloroform (Slightly), DMSO (Slightly)
- form
- Oil
- pka
- 7.86 · 7.86±0.50(Predicted)
- color
- Colourless
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+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
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Chemistry & industry
Applications
Usesβ-N-Benzyl-N''-methylaminopropiophenone is a useful reagent in asymmetric hydrogenation of amino ketones.
Suppliers21 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
Aladdin Scientific[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]
韶远科技（上海）有限公司4000665055 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
Related reactions
1 records
Compound notes
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