Basic information
- CAS
116256-11-2- Standard SMILES
COC1CN(CCCOc2ccc(F)cc2)CCC1=O- InChIKey
HEVIJEFDFFKZPG-UHFFFAOYSA-N- Molecular formula
- C15H20FNO3
- Average molar mass
- 281.32 g/mol
Names & identifiers
- Preferred name
- 1-[3-(4-Fluorophenoxy)propyl]-3-methoxy-4-piperidinone
- IUPAC
- 1-[3-(4-fluorophenoxy)propyl]-3-methoxypiperidin-4-one
- English name
- 1-(3-(4-fluorophenoxy)propyl)-3-methoxy-4-piperidinone
- Molecular formula
- C15H20FNO3
- Molecular weight
- 0
Names & synonyms
116256-11-21-(3-(4-FLUOROPHENOXY)PROPYL)-3-METHOXY-4-PIPERIDINONE1-[3-(4-fluorophenoxy)propyl]-3-methoxy-4-piperidinoneEC 411-500-7137472-67-4RefChem:74267411-500-71-[3-(4-FLUOROPHENOXY)PROPYL]-3-METHOXYPIPERIDIN-4-ONE1-(3-(4-Fluorophenoxy)propyl)-3-methoxypiperidin-4-oneSCHEMBL7703307DTXSID40453995DTXSID101208721
Show more names
NS00004632
Database identifiers
- CAS
116256-11-2、137472-67-4- PubChem CID
- 11065870
- DTXSID
DTXSID101208721- EC Number
- 411-500-7
- Nikkaji
- J562.889J
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 305
Physicochemical properties
- EWG's Food Scores
- 1 · 1-2
- Symbol(GHS)
- 5 · GHS05,GHS07,GHS09
- Signal word
- Danger
- Hazard statements
- 302 · H302-H317-H318-H411
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P280-P305+P351+P338-P310
- Hazard Codes
- Xn,N
- Risk Statements
- 22 · 22-41-43-51/53
- Safety Statements
- 22 · 22-24-26-37/39-61
- REACH Registrations
- Inactive
Safety & regulation
GHS classification
GHS Classification
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Hazard information
Regulatory InformationStatus: Cease Manufacture Update: 26-05-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/3335
Hazard Classes and Categories
Acute toxicity - category 4
Acute Tox. 4 *
Safety data
- risk_code
- 22-41-43-51/53
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07,GHS09
- hazard_code
- Xn,N
- safety_code
- 22-24-26-37/39-61
- Hazard statements
- H302-H317-H318-H411
- REACH Registrations
- Inactive
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P280-P305+P351+P338-P310
Chemistry & industry
Suppliers1 total
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
2 records
Compound notes
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