Methyl 2,6-dimethoxy-3-nitrobenzoate
Basic information
- CAS
55776-20-0- Standard SMILES
COC(=O)c1c(OC)ccc([N+](=O)[O-])c1OC- InChIKey
HVVQDBFINNUQBK-UHFFFAOYSA-N- Molecular formula
- C10H11NO6
- Average molar mass
- 241.2 g/mol
- Monoisotopic mass
- 241.05863707
Names & identifiers
- Preferred name
- Methyl 2,6-dimethoxy-3-nitrobenzoate
- IUPAC
- methyl 2,6-dimethoxy-3-nitrobenzoate
- English name
- Methyl 2,6-dimethoxy-3-nitrobenzoate
- Molecular formula
- C10H11NO6
- Molecular weight
- 241.2
Names & synonyms
Methyl 2,6-dimethoxy-3-nitrobenzoate55776-20-0DTXSID40334710RefChem:157234DTXCID00285799HVVQDBFINNUQBK-UHFFFAOYSA-NHMS544O03Maybridge1_001191Oprea1_717205SCHEMBL6902580CCG-45609MFCD00017339
Show more names
Methyl 2,6-Dimethoxy-3-Nitrobenzoate(WXC02477)Benzoic acid, 2,6-dimethoxy-3-nitro-, methyl ester
AKOS005829076methyl 2,6-dimethoxy-3-nitro-benzoateAS-62805CS-00773082,6-dimethoxy-3-nitrobenzoic acid methyl esterW11552SR-01000635363-1
Database identifiers
- CAS
55776-20-0- PubChem CID
- 521682
- DTXSID
DTXSID40334710
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 90.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 289
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Related reactions
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Compound notes
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