Basic information
- CAS
48172-89-0- Standard SMILES
Cc1cc(-c2cc(C)c(N)c(Br)c2)cc(Br)c1N- InChIKey
YAQXJVBDMWLLOL-UHFFFAOYSA-N- Molecular formula
- C14H14Br2N2
- Average molar mass
- 370.08 g/mol
- Monoisotopic mass
- 367.95237
Names & identifiers
- Preferred name
- (1,1'-Biphenyl)-4,4'-diamine, 3,3'-dibromo-5,5'-dimethyl-
- IUPAC
- 4-(4-amino-3-bromo-5-methylphenyl)-2-bromo-6-methylaniline
Names & synonyms
(1,1'-Biphenyl)-4,4'-diamine, 3,3'-dibromo-5,5'-dimethyl-48172-89-03,3'-Dibromo-5,5'-dimethyl-(1,1'-biphenyl)-4,4'-diamineSCHEMBL1392743DTXSID101974503,3'-Dibromo-5,5'-dimethyl[1,1'-biphenyl]-4,4'-diamine
Database identifiers
- CAS
48172-89-0- PubChem CID
- 148481
- DTXSID
DTXSID10197450
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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