2,5-Dimethoxybenzamide
Basic information
- CAS
42020-21-3- Standard SMILES
COc1ccc(OC)c(C(N)=O)c1- InChIKey
KLYZILOJVQMYSK-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- 2,5-Dimethoxybenzamide
- IUPAC
- 2,5-dimethoxybenzamide
- English name
- 2,5-Dimethoxybenzamide
- Molecular formula
- C9H11NO3
- Molecular weight
- 181.19
Names & synonyms
2,5-DIMETHOXYBENZAMIDE42020-21-3MFCD00017122NSC269901CHEMBL458645SCHEMBL1086016SCHEMBL1917633SCHEMBL30052013DTXSID70313391AKOS005151309FD70369NSC-269901
Show more names
Benzamide, 2,5-dimethoxy-
BS-28004CS-0205190H66416F635533
Database identifiers
- CAS
42020-21-3- PubChem CID
- 320829
- DTXSID
DTXSID70313391- ChEMBL
CHEMBL458645- Nikkaji
- J3.042.902H
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- HS Code
- 2924297099 · 2924297099
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2924297099
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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