Basic information
- CAS
93523-19-4- Standard SMILES
CCOc1ccc(NCCC(=O)c2cccs2)cc1- InChIKey
DKVGYCOOGZSUTR-UHFFFAOYSA-N- Molecular formula
- C15H17NO2S
- Average molar mass
- 275.4 g/mol
- Monoisotopic mass
- 275.09799996
Names & identifiers
- Preferred name
- 3-(4-Ethoxyanilino)-1-(2-thienyl)-1-propanone
- IUPAC
- 3-(4-ethoxyanilino)-1-thiophen-2-ylpropan-1-one
- English name
- 3-(4-ETHOXYANILINO)-1-(2-THIENYL)-1-PROPANONE
- Molecular formula
- C15H17NO2S
- Molecular weight
- 275.37
Names & synonyms
93523-19-43-(4-ethoxyanilino)-1-(2-thienyl)-1-propanoneRefChem:492972646-610-63-((4-Ethoxyphenyl)amino)-1-(thiophen-2-yl)propan-1-one3-[(4-ethoxyphenyl)amino]-1-(thiophen-2-yl)propan-1-oneCBMicro_037723Oprea1_6678983-(4-ethoxyanilino)-1-thiophen-2-ylpropan-1-oneAKOS005108317JS-2410BIM-0037463.P001
Show more names
SALOR-INT L232467-1EA
CS-0365470ST509962643-(4-ethoxyanilino)-1-(2-thienyl)propan-1-oneSR-01000223560SR-01000223560-13-[(4-ethoxyphenyl)amino]-1-(2-thienyl)propan-1-one
Database identifiers
- CAS
93523-19-4- PubChem CID
- 877409
- EC Number
- 646-610-6
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers4 total
Ryan Scientific, Inc.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
BIONET-INTER[email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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