Basic information
- CAS
309922-88-1- Standard SMILES
CCOC(=O)c1oc2ccccc2c1NC(=O)CCCl- InChIKey
UASUZMABIRHTLI-UHFFFAOYSA-N- Molecular formula
- C14H14ClNO4
- Average molar mass
- 295.72 g/mol
- Monoisotopic mass
- 295.0611356
Names & identifiers
- Preferred name
- Ethyl 3-[(3-chloro-1-oxopropyl)amino]-2-benzofurancarboxylate
- IUPAC
- ethyl 3-(3-chloropropanoylamino)-1-benzofuran-2-carboxylate
Names & synonyms
309922-88-1Ethyl 3-[(3-chloro-1-oxopropyl)amino]-2-benzofurancarboxylateEthyl 3-((3-chloro-1-oxopropyl)amino)-2-benzofurancarboxylateRefChem:343087ETHYL 3-(3-CHLOROPROPANAMIDO)-1-BENZOFURAN-2-CARBOXYLATEUASUZMABIRHTLI-UHFFFAOYSA-NDTXSID101181743Ethyl 3-[(3-chloropropanoyl)amino]-1-benzofuran-2-carboxylateSTK731382AKOS000510980ST001845SR-01000313186
Show more names
SR-01000313186-1ethyl 3-(3-chloropropanamido)benzofuran-2-carboxylateethyl 3-(3-chloropropanoylamino)benzo[d]furan-2-carboxylateEthyl 3-[(3-chloropropanoyl)amino]-1-benzofuran-2-carboxylate #2-Benzofurancarboxylic acid, 3-[(3-chloro-1-oxopropyl)amino]-, ethyl ester
Database identifiers
- CAS
309922-88-1- PubChem CID
- 609705
- DTXSID
DTXSID101181743
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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