2,6-Dibromo-1,4-phenylenediamine
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Basic information
- CAS
29213-03-4- Standard SMILES
Nc1cc(Br)c(N)c(Br)c1- InChIKey
NIXNGYGWQMXMCA-UHFFFAOYSA-N- Molecular formula
- C6H6Br2N2
- Average molar mass
- 265.93 g/mol
- Monoisotopic mass
- 263.88977
Names & identifiers
- Preferred name
- 2,6-Dibromo-1,4-phenylenediamine
- IUPAC
- 2,6-dibromobenzene-1,4-diamine
- English name
- 2,6-Dibromo-1,4-benzenediamine
- Molecular formula
- C6H6Br2N2
- Molecular weight
- 265.93
Names & synonyms
2,6-dibromo-1,4-phenylenediamine2,6-Dibromo-1,4-benzenediamineRefChem:445316805-815-22,6-dibromobenzene-1,4-diamine29213-03-4MFCD025754064-Amino-2,6-dibromoaniline2,5-Diamino-1,3-dibromobenzene2,6-Dibromo-benzene-1,4-diamine1,4-Benzenediamine, 2,6-dibromo-SMR000010620
Show more names
2,6-Dibromo-1,4-phenylenediamine>
MLS000030755SCHEMBL5076239SCHEMBL83198564-amino-2,6-dibromophenylamineCHEMBL1462899DTXSID803495651,4-Diamino-2,6-dibromobenzeneNIXNGYGWQMXMCA-UHFFFAOYSA-N
Database identifiers
- CAS
29213-03-4- PubChem CID
- 653341
- DTXSID
DTXSID80349565- ChEMBL
CHEMBL1462899- EC Number
- 805-815-2
- Nikkaji
- J88.589D
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Melting point
- 136 to · 136.0 to 140.0 °C
- Boiling point
- 332.5 · 332.5±37.0 °C(Predicted)
- Density
- 2.104 · 2.104±0.06 g/cm3(Predicted)
- pka
- 3.71 · 3.71±0.10(Predicted)
- form
- powder to crystal
- color
- Light yellow to Brown
- λmax
- 334 nm · 334nm(CH3CN)(lit.)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- HS Code
- 2921.51 · 2921.51.5000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2921.51.5000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Related reactions
6 records
Compound notes
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