1H-Imidazole, 1,1'-(1,2-phenylenedicarbonyl)bis-
Basic information
- CAS
68413-79-6- Standard SMILES
O=C(c1ccccc1C(=O)n1ccnc1)n1ccnc1- InChIKey
PJWURJVLYPGKCO-UHFFFAOYSA-N- Molecular formula
- C14H10N4O2
- Average molar mass
- 266.25 g/mol
- Monoisotopic mass
- 266.08037557
Names & identifiers
- Preferred name
- 1H-Imidazole, 1,1'-(1,2-phenylenedicarbonyl)bis-
- IUPAC
- [2-(imidazole-1-carbonyl)phenyl]-imidazol-1-ylmethanone
- English name
- 1,1'-(1,2-phenylenedicarbonyl)bis-1H-imidazole
- Molecular formula
- C14H10N4O2
- Molecular weight
- 266.25
Names & synonyms
Phthalic acid, imidazole diamide1H-Imidazole, 1,1'-(1,2-phenylenedicarbonyl)bis-68413-79-6UJ6649K4E4EINECS 270-251-01,1'-(1,2-Phenylenedicarbonyl)bis-1H-imidazoleDTXSID70715211,1'-(1,2-PHENYLENEDICARBONYL)BIS(1H-IMIDAZOLE)1,1'-(1,2-Phenylenedicarbonyl)bis[1H-imidazole]RefChem:438243DTXCID8045981270-251-0
Show more names
UNII-UJ6649K4E4SCHEMBL30366356PJWURJVLYPGKCO-UHFFFAOYSA-NNS00036591(1,2-Phenylene)bis[(1H-imidazol-1-yl)methanone]
Database identifiers
- CAS
68413-79-6- PubChem CID
- 110223
- DTXSID
DTXSID7071521- UNII
- UJ6649K4E4
- EC Number
- 270-251-0
- Nikkaji
- J332.528H
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 69.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- FDA UNII
- 6649 K4E4 · UJ6649K4E4
- EPA Substance Registry System
- 1 H-Imidazole, · 1H-Imidazole, 1,1'-(1,2-phenylenedicarbonyl)bis- (68413-79-6)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Imidazole, 1,1'-(1,2-phenylenedicarbonyl)bis-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…