Basic information
- CAS
66611-15-2- Standard SMILES
CC(=O)c1coc2ccccc12- InChIKey
CHGABJRZTFUHDT-UHFFFAOYSA-N- Molecular formula
- C10H8O2
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.0524295
Names & identifiers
- Preferred name
- 1-(1-Benzofuran-3-yl)ethan-1-one
- IUPAC
- 1-(1-benzofuran-3-yl)ethanone
- English name
- 3-Acetylbenzo[b]furan
- Molecular formula
- C10H8O2
- Molecular weight
- 160.17
Names & synonyms
1-(1-benzofuran-3-yl)ethan-1-oneRefChem:419636827-348-33-Acetylbenzo[b]furan66611-15-21-(benzofuran-3-yl)ethanone1-(1-benzofuran-3-yl)ethanone3-acetylbenzofuranMFCD062274421-benzofuran-3-yl-ethanoneSCHEMBL638083SCHEMBL1299217
Show more names
1-(Benzofuran-3-yl)ethan-1-oneEthanone, 1-(3-benzofuranyl)-Ethanone, 1-(3-benzofuranyl)- (9CI)1-(benzofuran-3-yl)ethanone(WXC08507)
SCHEMBL3483113SCHEMBL3483173DTXSID50461162CHGABJRZTFUHDT-UHFFFAOYSA-NRCA61115AKOS005215846FS-2106DB-121087
Database identifiers
- CAS
66611-15-2- PubChem CID
- 11286612
- DTXSID
DTXSID50461162- EC Number
- 827-348-3
- Nikkaji
- J2.640.848B
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Melting point
- 36 °C · 36 °C
- Boiling point
- 120 · 120-135 °C(Press: 14 Torr)
- Density
- 1.161 · 1.161±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
Uses1-(1-Benzofuran-3-yl)ethanone can be useful in the preparation indolyl chalcone derivatives and study of their antimalarial activity.
Upstream & downstream products
Downstream products
Suppliers12 total
宁波振岳医药科技有限公司19817745290 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海奈亦斯生物科技有限公司18321139117 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
11 records
Compound notes
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