Basic information
- CAS
98851-85-5- Standard SMILES
CCONC=Nc1ccc(OCC)cc1C- InChIKey
UPYYBPGDNUGMQW-UHFFFAOYSA-N- Molecular formula
- C12H18N2O2
- Average molar mass
- 222.28 g/mol
- Monoisotopic mass
- 222.13682782
Names & identifiers
- Preferred name
- Methanimidamide, N-ethoxy-N'-(4-ethoxy-2-methylphenyl)-
- IUPAC
- N-ethoxy-N'-(4-ethoxy-2-methylphenyl)methanimidamide
Names & synonyms
N-ethoxy-N'-(4-ethoxy-2-methylphenyl)methanimidamideMethanimidamide, N-ethoxy-N'-(4-ethoxy-2-methylphenyl)-98851-85-5CHEMBL2286286DTXSID30243842N'-ETHOXY-N-(4-ETHOXY-2-METHYLPHENYL)FORMIMIDAMIDE
Database identifiers
- CAS
98851-85-5- PubChem CID
- 176802
- DTXSID
DTXSID30243842- ChEMBL
CHEMBL2286286- Nikkaji
- J466.465E
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 209
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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