Methyl 3-(2-amino-4-chlorophenoxy)thiophene-2-carboxylate
Basic information
- CAS
91041-14-4- Standard SMILES
COC(=O)c1sccc1Oc1ccc(Cl)cc1N- InChIKey
UDPBFZJYXAMGMX-UHFFFAOYSA-N- Molecular formula
- C12H10ClNO3S
- Average molar mass
- 283.73 g/mol
- Monoisotopic mass
- 283.006992
Names & identifiers
- Preferred name
- Methyl 3-(2-amino-4-chlorophenoxy)thiophene-2-carboxylate
- IUPAC
- methyl 3-(2-amino-4-chlorophenoxy)thiophene-2-carboxylate
Names & synonyms
Oprea1_523476Methyl 3-(2-amino-4-chlorophenoxy)-2-thiophenecarboxylatemethyl 3-(2-amino-4-chlorophenoxy)thiophene-2-carboxylateDTXSID50119735691041-14-4
Database identifiers
- CAS
91041-14-4- PubChem CID
- 2808263
- DTXSID
DTXSID501197356
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 305
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Compound notes
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