Urea, N,N'-bis((3-bromophenyl)phenylmethyl)-
Basic information
- CAS
160807-87-4- Standard SMILES
O=C(NC(c1ccccc1)c1cccc(Br)c1)NC(c1ccccc1)c1cccc(Br)c1- InChIKey
FRFGCJSRQWMGRY-UHFFFAOYSA-N- Molecular formula
- C27H22Br2N2O
- Average molar mass
- 550.3 g/mol
- Monoisotopic mass
- 548.00989
Names & identifiers
- Preferred name
- Urea, N,N'-bis((3-bromophenyl)phenylmethyl)-
- IUPAC
- 1,3-bis[(3-bromophenyl)-phenylmethyl]urea
- English name
- 1,3-bis[(3-bromophenyl)-phenyl-methyl]urea
- Molecular formula
- C27H22Br2N2O
- Molecular weight
- 550.28
Names & synonyms
N,N'-Bis((3-bromophenyl)phenylmethyl)urea160807-87-4Urea, N,N'-bis((3-bromophenyl)phenylmethyl)-RefChem:3877371,3-bis[(3-bromophenyl)-phenylmethyl]urea1,3-BIS[(3-BROMOPHENYL)-PHENYL-METHYL]UREADTXSID70936408N,N'-Bis[(3-bromophenyl)(phenyl)methyl]carbamimidic acidUrea, N,N'-bis[(3-bromophenyl)phenylmethyl]-
Database identifiers
- CAS
160807-87-4- PubChem CID
- 3074697
- DTXSID
DTXSID70936408
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 528
Physicochemical properties
- Boiling point
- 702.7 · 702.7±60.0 °C(Predicted)
- Density
- 1.47 · 1.470±0.06 g/cm3(Predicted)
- pka
- 12.37 · 12.37±0.46(Predicted)
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Compound notes
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