2-Methoxy-4-nitrophenol acetate
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Basic information
- CAS
108164-88-1- Standard SMILES
COc1cc([N+](=O)[O-])ccc1OC(C)=O- InChIKey
DIKOVRNHZKVROR-UHFFFAOYSA-N- Molecular formula
- C9H9NO5
- Average molar mass
- 211.17 g/mol
- Monoisotopic mass
- 211.04807239
Names & identifiers
- Preferred name
- 2-Methoxy-4-nitrophenol acetate
- IUPAC
- (2-methoxy-4-nitrophenyl) acetate
Names & synonyms
2-methoxy-4-nitrophenyl acetate2-METHOXY-4-NITROPHENOL ACETATE67851-29-0DTXSID60218088RefChem:474406DTXCID80140579661-778-02-Methoxy-4-nitrophenol acetate (conjugate monoacid)Phenol, 2-methoxy-4-nitro-, conjugate acid (1:1)108164-88-1SCHEMBL11440204-acetoxy-3-methoxynitrobenzene
Show more names
MFCD00094705AKOS024339094SY292593Acetic acid 4-nitro-2-methoxy-phenyl EsterAcetic acid, 2-methoxy-4-nitrophenyl ester
Database identifiers
- CAS
108164-88-1、67851-29-0- PubChem CID
- 49985
- DTXSID
DTXSID60218088- EC Number
- 661-778-0
- Nikkaji
- J1.623.761B
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
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Related reactions
5 records
Compound notes
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