Methyl(2-iodo-4,5-dimethoxyphenyl)acetate
Basic information
- CAS
35345-49-4- Standard SMILES
COC(=O)Cc1cc(OC)c(OC)cc1I- InChIKey
GJHOWQCDFQFKKH-UHFFFAOYSA-N- Molecular formula
- C11H13IO4
- Average molar mass
- 336.12 g/mol
- Monoisotopic mass
- 335.98586
Names & identifiers
- Preferred name
- Methyl(2-iodo-4,5-dimethoxyphenyl)acetate
- IUPAC
- methyl 2-(2-iodo-4,5-dimethoxyphenyl)acetate
Names & synonyms
35345-49-4methyl(2-iodo-4,5-dimethoxyphenyl)acetateDTXSID60301085RefChem:356904DTXCID50252219methyl 2-(2-iodo-4,5-dimethoxyphenyl)acetateNSC140930methyl 2-(2-iodo-4,5-dimethoxy-phenyl)acetateSCHEMBL29025520AKOS004117377NSC-140930DS-011396
Show more names
Methyl (2-iodo-4,5-dimethoxyphenyl)acetateEN300-732941
Database identifiers
- CAS
35345-49-4- PubChem CID
- 284745
- DTXSID
DTXSID60301085- Nikkaji
- J1.221.659I
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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