2,4-Dimethoxybenzene-1-carbonyl cyanide
Basic information
- CAS
72371-47-2- Standard SMILES
COc1ccc(C(=O)C#N)c(OC)c1- InChIKey
AXKKSYFFDBSJND-UHFFFAOYSA-N- Molecular formula
- C10H9NO3
- Average molar mass
- 191.18 g/mol
- Monoisotopic mass
- 191.05824315
Names & identifiers
- Preferred name
- 2,4-Dimethoxybenzene-1-carbonyl cyanide
- IUPAC
- 2,4-dimethoxybenzoyl cyanide
Names & synonyms
72371-47-2NSC 231534NSC2315342,4-Dimethoxybenzene-1-carbonyl cyanideDTXSID10310748NSC-231534
Database identifiers
- CAS
72371-47-2- PubChem CID
- 314252
- DTXSID
DTXSID10310748
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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