2-chloro-7-hydroxy-6-methyl-4,5-dioxo-1H-indole-3-carbaldehyde
Basic information
- CAS
73355-44-9- Standard SMILES
CC1=C(O)c2[nH]c(Cl)c(C=O)c2C(=O)C1=O- InChIKey
OMXBQKCIQLIDJH-UHFFFAOYSA-N- Molecular formula
- C10H6ClNO4
- Average molar mass
- 239.61 g/mol
- Monoisotopic mass
- 238.9985354
Names & identifiers
- Preferred name
- 2-chloro-7-hydroxy-6-methyl-4,5-dioxo-1H-indole-3-carbaldehyde
- IUPAC
- 2-chloro-7-hydroxy-6-methyl-4,5-dioxo-1H-indole-3-carbaldehyde
- English name
- 2-chloro-7-hydroxy-6-methyl-4,5-dioxo-1H-indole-3-carbaldehyde
- Molecular formula
- C10H6ClNO4
- Molecular weight
- 0
Names & synonyms
73355-44-92-chloro-7-hydroxy-6-methyl-4,5-dioxo-1H-indole-3-carbaldehydeNSC-315183UNII-7966N52VDU7966N52VDU1H-Indole-3-carboxaldehyde, 2-chloro-4,7-dihydro-5-hydroxy-6-methyl-4,7-dioxo-2-chloro-4,7-dihydro-5-hydroxy-6-methyl-4,7-dioxo-1H-indole-3-carboxaldehydeNSC315183DTXSID60317383Q272667152-Chloro-7-hydroxy-6-methyl-4,5-dioxo-4,5-dihydro-1H-indole-3-carbaldehyde
Database identifiers
- CAS
73355-44-9- PubChem CID
- 329924
- DTXSID
DTXSID60317383- UNII
- 7966N52VDU
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 87.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 417
Physicochemical properties
- FDA UNII
- 7966 N52VDU · 7966N52VDU
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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