Basic information
- CAS
150494-06-7- Standard SMILES
CN(CCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1)N=O- InChIKey
AMFPKCLSNGLBNR-UHFFFAOYSA-N- Molecular formula
- C17H17F3N2O2
- Average molar mass
- 338.32 g/mol
- Monoisotopic mass
- 338.12421228
Names & identifiers
- Preferred name
- Methyl(nitroso)(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)amine
- IUPAC
- N-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]nitrous amide
- English name
- Benzenepropanamine, N-methyl-N-nitroso-γ-[4-(trifluoromethyl)phenoxy]-
- Molecular formula
- C17H17F3N2O2
- Molecular weight
- 338.32
Names & synonyms
150494-06-7methyl(nitroso){3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl}amineMethyl(nitroso)(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)amineRefChem:818422875-686-5N-Nitroso FluoxetineN-nitroso-fluoxetineN-NitrosofluoxetineN-Methyl-N-(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)nitrous AmideN-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]nitrous AmideN-Methyl-N-nitroso-gamma-[4-(trifluoromethyl)phenoxy]benzenepropanamineN-Nitrosofluoxetine 0.1 mg/ml in Methanol
Show more names
Fluoxetine Impurity 42NNitroso Fluoxetine,N Nitroso FluoxetineN-Nitroso fluoxetine, 100 μg/mL in MethanolFluoxetine Hydrochloride Impurity 33 (N-Nitroso Fluoxetine)Benzenepropanamine, N-methyl-N-nitroso-γ-[4-(trifluoromethyl)phenoxy]-N-Nitroso FluoxetineQ: What is N-Nitroso Fluoxetine Q: What is the CAS Number of N-Nitroso Fluoxetine Q: What is the storage condition of N-Nitroso Fluoxetine
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 379
Physicochemical properties
- Boiling point
- 470.2 · 470.2±45.0 °C(Predicted)
- Density
- 1.2 · 1.20±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- Chloroform: slightly soluble,Dichloromethane: slightly soluble
- form
- A solid
- pka
- -4.2 · -4.20±0.70(Predicted)
- Symbol(GHS)
- 8 · GHS08,GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H351-H315-H302
- Precautionary statements
- 201 · P201-P202-P281-P308+P313-P405-P501-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+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.
GHS classification
GHS Classification
Danger
H301 (25%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P260, P261, P263, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (25%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS08,GHS07
- Hazard statements
- H319-H335-H351-H315-H302
- Precautionary statements
- P201-P202-P281-P308+P313-P405-P501-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Applications
UsesN-Nitroso Fluoxetine is a derivative of Fluoxetine Hydrochloride(F597100) which is a selective serotonin reuptake inhibitor (SSRI). Used as an antidepressant.
Suppliers36 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
南京圣亿来化工有限公司19951936396 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
大赛璐药物手性技术（上海）有限公司021-50460086-9 15921403865 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
山东博洛达生物科技有限公司0531-68651502 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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