| CAS Number | 32460-07-4 |
| Catalog Number | AG00CM3R(AGN-PC-03P68J) |
| Chemical Name | Ethyl 3-bromofuran-2-carboxylate |
| IUPAC Name | ethyl 3-bromofuran-2-carboxylate |
| InChI | InChI=1S/C7H7BrO3/c1-2-10-7(9)6-5(8)3-4-11-6/h3-4H,2H2,1H3 |
| InChI Key | FCEFSCZCMZCMES-UHFFFAOYSA-N |
| MDL Number | MFCD24387450 |
| Molecular Formula | C7H7BrO3 |
| Molecular Weight | 219.0327 |
| SMILES | O=C(C1=C(Br)C=CO1)OCC |
| Synonyms | ethyl 3-bromofuran-2-carboxylate,
32460-07-4,
2-Furancarboxylic acid, 3-bromo-, ethyl ester,
SCHEMBL106736,
CTK1B9206,
DTXSID90625726,
ethyl 3-bromo-2-furancarboxylate,
FCEFSCZCMZCMES-UHFFFAOYSA-N,
MFCD24387450,
AKOS027337687,
ZINC113140105,
CS-0061557,
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| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.034g/mol |
| Monoisotopic Mass | 217.958g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 39.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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Hazard statements
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H302
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Packing Group
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Precautionary statements
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P264-P270-P301+P312-P330
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UN Code
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Certificate of Analysis
Lot Number