Basic information
- CAS
73941-42-1- Standard SMILES
O=[N+]([O-])c1cccc(C2N(c3ccccc3)CCN2c2ccccc2)c1- InChIKey
HIIHAYFNKUFGER-UHFFFAOYSA-N- Molecular formula
- C21H19N3O2
- Average molar mass
- 345.4 g/mol
- Monoisotopic mass
- 345.14772686
Names & identifiers
- Preferred name
- Imidazolidine, 1,3-diphenyl-2-(m-nitrophenyl)-
- IUPAC
- 2-(3-nitrophenyl)-1,3-diphenylimidazolidine
- English name
- CB-5173
- Molecular formula
- C21H19N3O2
- Molecular weight
- 345.39
Names & synonyms
73941-42-1BRN 0934191IMIDAZOLIDINE, 1,3-DIPHENYL-2-(m-NITROPHENYL)-2-(m-Nitrophenyl)-1,3-diphenylimidazolidineDTXSID002246435-23-06-00046 (Beilstein Handbook Reference)RefChem:348925DTXCID301471342-(3-nitrophenyl)-1,3-diphenylimidazolidineCB-5173CBMicro_013134Oprea1_552280
Show more names
1,3-Diphenyl-2-(m-nitrophenyl)imidazolidine1,3-Diphenyl-2-(3-nitrophenyl)imidazolidineImidazolidine, 2-(3-nitrophenyl)-1,3-diphenyl-
Oprea1_676868SMSF0004075STK042255AKOS000485555CB03408CCG-245867UPCMLD0ENAT5261608:001ST026445
Database identifiers
- CAS
73941-42-1- PubChem CID
- 52817
- DTXSID
DTXSID00224643- Nikkaji
- J61.625G
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 442
Physicochemical properties
- Boiling point
- 526.3 · 526.3±50.0 °C(Predicted)
- Density
- 1.254 · 1.254±0.06 g/cm3(Predicted)
- pka
- 4.07 · 4.07±0.60(Predicted)
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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