1(4H)-Naphthalenone, 8-amino-2,6-dibromo-5-hydroxy-4-imino-
Basic information
- CAS
26846-51-5- Standard SMILES
N=C1C=C(Br)C(=O)c2c(N)cc(Br)c(O)c21- InChIKey
VSUFHHMQOAFXIU-UHFFFAOYSA-N- Molecular formula
- C10H6Br2N2O2
- Average molar mass
- 345.97 g/mol
- Monoisotopic mass
- 343.8796
Names & identifiers
- Preferred name
- 1(4H)-Naphthalenone, 8-amino-2,6-dibromo-5-hydroxy-4-imino-
- IUPAC
- 8-amino-2,6-dibromo-5-hydroxy-4-iminonaphthalen-1-one
- English name
- 8-amino-2,6-dibromo-5-hydroxy-4-iminonaphthalen-1(4H)-one
- Molecular formula
- C10H6Br2N2O2
- Molecular weight
- 345.97
Names & synonyms
26846-51-5BRN 3325965EINECS 248-044-11(4H)-NAPHTHALENONE, 8-AMINO-2,6-DIBROMO-5-HYDROXY-4-IMINO-5-Amino-8-hydroxy-3,7-dibromo-1,4-naphthoquinone imine3,7-Dibromo-5-amino-8-hydroxy-1,4-naphthoquinone-1-imineDTXSID10672578-Amino-2,6-dibromo-5-hydroxy-4-imino-1(4H)-naphthalenone4-14-00-00869 (Beilstein Handbook Reference)RefChem:70714DTXCID00375788-Amino-2,6-dibromo-5-hydroxy-4-iminonaphthalen-1(4H)-one
Show more names
5-AMINO-8-HYDROXY-3,7-DIBROMO-1,4-NAPHTHOQUINONEIMINE2,6-Dibromo-4-imino-8-amino-5-hydroxynaphthalene-1(4H)-one
73384-68-6EINECS 277-410-34,8-Diamino-2,6-dibromo-1,5-naphthoquinone4,8-diamino-2,6-dibromonaphthalene-1,5-dioneSCHEMBL10882937DTXSID60994092VSUFHHMQOAFXIU-UHFFFAOYSA-NNS00050776
Database identifiers
- CAS
26846-51-5、73384-68-6- PubChem CID
- 33626
- DTXSID
DTXSID1067257- EC Number
- 248-044-1、277-410-3
- Nikkaji
- J249.062E、J309.288G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 87.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 383
Physicochemical properties
- Boiling point
- 499.4 · 499.4±45.0 °C(Predicted)
- Density
- 2.3 · 2.30±0.1 g/cm3(Predicted)
- pka
- 5.87 · 5.87±0.20(Predicted)
- EPA Substance Registry System
- 1 · 1(4H)-Naphthalenone, 8-amino-2,6-dibromo-5-hydroxy-4-imino- (26846-51-5)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1(4H)-Naphthalenone, 8-amino-2,6-dibromo-5-hydroxy-4-imino-: ACTIVE
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Compound notes
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