2-(2-(((1,1'-Biphenyl)4-yloxy)AC)carbohydrazonoyl)-4-BR-PH 3,4-dimethoxybenzoate
Basic information
- CAS
881467-22-7- Standard SMILES
COc1ccc(C(=O)Oc2ccc(Br)cc2/C=N/NC(=O)COc2ccc(-c3ccccc3)cc2)cc1OC- InChIKey
QBDVDNLHHOHQHS-KCSSXMTESA-N- Molecular formula
- C30H25BrN2O6
- Average molar mass
- 589.4 g/mol
- Monoisotopic mass
- 588.0896
Names & identifiers
- Preferred name
- 2-(2-(((1,1'-Biphenyl)4-yloxy)AC)carbohydrazonoyl)-4-BR-PH 3,4-dimethoxybenzoate
- IUPAC
- [4-bromo-2-[(E)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate
Names & synonyms
AKOS0244107632-(2-(((1,1'-BIPHENYL)4-YLOXY)AC)CARBOHYDRAZONOYL)-4-BR-PH 3,4-DIMETHOXYBENZOATE
Database identifiers
- CAS
881467-22-7- PubChem CID
- 9629705
- EC Number
- 129-433-4
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 798
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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