Ethyl 2-amino-4-hydroxy-3-thiophenecarboxylate
Basic information
- CAS
16694-23-8- Standard SMILES
CCOC(=O)c1c(O)csc1N- InChIKey
MWNFUBNNWKPURP-UHFFFAOYSA-N- Molecular formula
- C7H9NO3S
- Average molar mass
- 187.22 g/mol
- Monoisotopic mass
- 187.03031432
Names & identifiers
- Preferred name
- Ethyl 2-amino-4-hydroxy-3-thiophenecarboxylate
- IUPAC
- ethyl 2-amino-4-hydroxythiophene-3-carboxylate
- English name
- 2-Amino-4-hydroxy-3-thiophenecarboxylic acid ethyl ester
- Molecular formula
- C7H9NO3S
- Molecular weight
- 187.22
Names & synonyms
16694-23-8Ethyl 2-amino-4-hydroxy-3-thiophenecarboxylateDTXSID30302741RefChem:342623DTXCID80253875ethyl 2-amino-4-hydroxythiophene-3-carboxylate3-Thiophenecarboxylic acid, 2-amino-4-hydroxy-, ethyl ester2-amino-4-hydroxy-3-thiophenecarboxylic acid ethyl esterNSC153307SCHEMBL8907488MWNFUBNNWKPURP-UHFFFAOYSA-NNSC-153307
Show more names
ethyl2-amino-4-hydroxythiophene-3-carboxylateEthyl 2-amino-4-hydroxy-3-thiophenecarboxylate #
Database identifiers
- CAS
16694-23-8- PubChem CID
- 290217
- DTXSID
DTXSID30302741- Nikkaji
- J103.762E
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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