Methyl 5-methoxy-3-nitroso-1H-indole-2-carboxylate
Basic information
- CAS
594857-91-7- Standard SMILES
COC(=O)c1[nH]c2ccc(OC)cc2c1N=O- InChIKey
BQSIGIOPYZMOJO-UHFFFAOYSA-N- Molecular formula
- C11H10N2O4
- Average molar mass
- 234.21 g/mol
- Monoisotopic mass
- 234.0640568
Names & identifiers
- Preferred name
- Methyl 5-methoxy-3-nitroso-1H-indole-2-carboxylate
- IUPAC
- methyl 5-methoxy-3-nitroso-1H-indole-2-carboxylate
Names & synonyms
Methyl 5-methoxy-3-nitroso-1H-indole-2-carboxylate594857-91-7DTXSID70787134
Database identifiers
- CAS
594857-91-7- PubChem CID
- 71363619
- DTXSID
DTXSID70787134
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 80.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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