4,4'-Iminobis(benzenecarboximidamide)
Basic information
- CAS
15535-96-3- Standard SMILES
N=C(N)c1ccc(Nc2ccc(C(=N)N)cc2)cc1- InChIKey
OOSANNOCGQRXSP-UHFFFAOYSA-N- Molecular formula
- C14H15N5
- Average molar mass
- 253.3 g/mol
- Monoisotopic mass
- 253.1327455
Overview
structure given in first source
Names & identifiers
- Preferred name
- 4,4'-Iminobis(benzenecarboximidamide)
- IUPAC
- 4-(4-carbamimidoylanilino)benzenecarboximidamide
- English name
- 4,4'-iminodibenzamidine
- Molecular formula
- C14H15N5
- Molecular weight
- 253.3024
Names & synonyms
15535-96-34,4'-diamidinodiphenylamineDTXSID60165881RefChem:911832DTXCID10883724,4'-Iminobis(benzenecarboximidamide)M&B-938239-582-84,4'-Iminodibenzamidine4-(4-carbamimidoylanilino)benzenecarboximidamide4,4'-Azanediyldibenzimidamide4,4/'-Iminodibenzamidine
Show more names
Diamidinodiphenylamine4,4'-IminobisbenzamidineBenzenecarboximidamide, 4,4'-iminobis-
EINECS 239-582-8M&B 9384,4'-Azanediyldi(benzene-1-carboximidamide)NS00025044
Database identifiers
- CAS
15535-96-3- PubChem CID
- 84973
- DTXSID
DTXSID60165881- EC Number
- 239-582-8
- Nikkaji
- J221.527F
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 293
Physicochemical properties
- Boiling point
- 446.4 · 446.4±55.0 °C(Predicted)
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- pka
- 12.98 · 12.98±0.50(Predicted)
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Related reactions
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Compound notes
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