N-(2-methoxyphenyl)imidodicarbonimidic diamide
Basic information
- CAS
69025-51-0- Standard SMILES
COc1ccccc1N=C(N)N=C(N)N- InChIKey
QYLVXKQJMSWUHI-UHFFFAOYSA-N- Molecular formula
- C9H13N5O
- Average molar mass
- 207.23 g/mol
- Monoisotopic mass
- 207.11201006
Names & identifiers
- Preferred name
- N-(2-methoxyphenyl)imidodicarbonimidic diamide
- IUPAC
- 1-(diaminomethylidene)-2-(2-methoxyphenyl)guanidine
- English name
- N-(2-Methoxyphenyl)imidodicarbonimidic diamide hydrochloride
- Molecular formula
- C9H13N5O
- Molecular weight
- 207.23
Names & synonyms
69025-51-0N-(2-methoxyphenyl)imidodicarbonimidic diamideimidodicarbonimidic diamide, n-(2-methoxyphenyl)-1-(diaminomethylidene)-2-(2-methoxyphenyl)guanidine1-carbamimidamido-N-(2-methoxyphenyl)methanimidamideMFCD00448704NSC1252072-MethoxyphenylbiguanideImidodicarbonimidicdiamide, N-(2-methoxyphenyl)-SCHEMBL4100435DTXSID30988781ALBB-022030
Show more names
1-(diaminomethylene)-2-(2-methoxyphenyl)guanidine
SBB072781STK107676AKOS001029379AKOS003348959NSC-125207LS-06776ST104920N-(2-Methoxyphenyl)triimidodicarbonic diamide
Database identifiers
- CAS
69025-51-0- PubChem CID
- 276772
- DTXSID
DTXSID30988781
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Boiling point
- 322.2 · 322.2±44.0 °C(Predicted)
- Density
- 1.34 · 1.34±0.1 g/cm3(Predicted)
- pka
- 11.61 · 11.61±0.10(Predicted)
- HS Code
- 2925290090 · 2925290090
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
- 2925290090
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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