Basic information
- CAS
1646-32-8- Standard SMILES
CC(=O)c1cc2cc(Cl)ccc2o1- InChIKey
CRKKDXCKRYPNFM-UHFFFAOYSA-N- Molecular formula
- C10H7ClO2
- Average molar mass
- 194.61 g/mol
- Monoisotopic mass
- 194.0134572
Names & identifiers
- Preferred name
- 1-(5-Chloro-1-benzofuran-2-yl)ethan-1-one
- IUPAC
- 1-(5-chloro-1-benzofuran-2-yl)ethanone
- English name
- 1-(5-CHLOROBENZO[B]FURAN-2-YL)ETHAN-1-ONE
- Molecular formula
- C10H7ClO2
- Molecular weight
- 194.61
Names & synonyms
1646-32-81-(5-chloro-1-benzofuran-2-yl)ethan-1-oneDTXSID60384535RefChem:426338DTXCID30335559997-934-21-(5-chloro-1-benzofuran-2-yl)ethanone1-(5-chlorobenzofuran-2-yl)ethanone1-(5-Chlorobenzofuran-2-yl)ethan-1-one1-(5-chlorobenzo[b]furan-2-yl)ethan-1-oneEthanone, 1-(5-chloro-2-benzofuranyl)-MFCD00661909
Show more names
1-(5-Chloro-2-benzofuranyl)-Ethanone1-(5-Chlorobenzofuran-2-yl)ethan-1-one - [C93540]
2-acetyl-5-chlorobenzo[b]furanEthanone,1-(5-chloro-2-benzofuranyl)-Maybridge1_003591SCHEMBL6894785HMS551L05ALBB-020427SBB091802AKOS000348793
Database identifiers
- CAS
1646-32-8- PubChem CID
- 2807014
- DTXSID
DTXSID60384535- EC Number
- 997-934-2
- Nikkaji
- J873.857B
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Melting point
- 97 °C · 97 °C
- Boiling point
- 175 °C · 175 °C(Press: 12 Torr)
- Density
- 1.298 · 1.298±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- Appearance
- White to off-white Solid
- CAS DataBase Reference
- 1646 · 1646-32-8
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P271-P261-P270-P264-P304-P340-P312-P301-P330-P302-P352-P362-2-P363-P332-P313-P305-P351-P338-P337-P405-P501
- HS Code
- 2932209090 · 2932209090
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]
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
- hs_code
- 2932209090
- Signal word
- Warning
- Hazard statements
- H302-H312-H315-H319-H332-H335
- Precautionary statements
- P280-P271-P261-P270-P264-P304-P340-P312-P301-P330-P302-P352-P362-2-P363-P332-P313-P305-P351-P338-P337-P405-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers18 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
卡迪亚医药科技有限公司0371-86615086 18203638366 0371-86159066 13526786601
上海广洋嘉莉生物科技有限公司13127532723 · [email protected]
上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海凯乐迪亚生物医药有限公司021-18800336901 18800336901 · [email protected]
上海新作博生物医药科技有限公司021-18800336901 15821600833 · [email protected]
上海普黎康化工科技有限公司021-54321516 17717324060 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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