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2,4-Dichlorophenyl 1-benzofuran-2-carboxylate

HCID 725713
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
304889-52-9
Standard SMILES
O=C(Oc1ccc(Cl)cc1Cl)c1cc2ccccc2o1
InChIKey
YNRYUTQJXXLDDX-UHFFFAOYSA-N
Molecular formula
C15H8Cl2O3
Average molar mass
307.1 g/mol
Monoisotopic mass
305.9850495

Names & identifiers

Preferred name
2,4-Dichlorophenyl 1-benzofuran-2-carboxylate
IUPAC
(2,4-dichlorophenyl) 1-benzofuran-2-carboxylate
English name
2,4-dichlorophenyl benzofuran-2-carboxylate
Molecular formula
C15H8Cl2O3
Molecular weight
307.13

Names & synonyms

2,4-dichlorophenyl 1-benzofuran-2-carboxylate304889-52-9Oprea1_235490Oprea1_515481STL331329AKOS0016134972,4-dichlorophenyl benzofuran-2-carboxylateST501855262,4-dichlorophenyl benzo[d]furan-2-carboxylateSR-01000410641SR-01000410641-12-Benzofurancarboxylic acid, 2,4-dichlorophenyl ester

Database identifiers

CAS
304889-52-9
PubChem CID
725713
EC Number
141-209-8

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
39.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
363

Physicochemical properties

Boiling point
465.7 · 465.7±40.0 °C(Predicted)
Density
1.437 · 1.437±0.06 g/cm3(Predicted)

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 · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, 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%)

Chemistry & industry

Suppliers2 total

Interbioscreen Ltd.[email protected]
西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]

Related reactions

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Compound notes

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