Methyl cyanoformimidate
Basic information
- CAS
13369-03-4- Standard SMILES
COC(=N)C#N- InChIKey
YYKFOMDVFMMBGQ-UHFFFAOYSA-N- Molecular formula
- C3H4N2O
- Average molar mass
- 84.08 g/mol
- Monoisotopic mass
- 84.03236276
Names & identifiers
- Preferred name
- Methyl cyanoformimidate
- IUPAC
- methyl cyanomethanimidate
- English name
- methyl cyanoformimidate
- Molecular formula
- C3H4N2O
- Molecular weight
- 84.07666
Names & synonyms
Methyl cyanoformimidate13369-03-4EINECS 236-439-1Methyl carbonocyanidimidateSCHEMBL6338389DTXSID10928241YYKFOMDVFMMBGQ-UHFFFAOYSA-NNS00053776Carbonocyanidimidic acid methyl ester
Database identifiers
- CAS
13369-03-4- PubChem CID
- 83385
- DTXSID
DTXSID10928241- EC Number
- 236-439-1
- Nikkaji
- J213.878F
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 56.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 98.6
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Compound notes
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