Basic information
- CAS
6954-48-9- Standard SMILES
O=C1C=Cc2cc(Br)ccc2C1=O- InChIKey
MXWZRRPNVLCHMY-UHFFFAOYSA-N- Molecular formula
- C10H5BrO2
- Average molar mass
- 237.05 g/mol
- Monoisotopic mass
- 235.94729
Overview
for prevention of influenza & respiratory diseases; Russian drug; structure
Names & identifiers
- Preferred name
- 6-Bromo-1,2-naphthoquinone
- IUPAC
- 6-bromonaphthalene-1,2-dione
- English name
- bonafton
- Molecular formula
- C10H5BrO2
- Molecular weight
- 237.05
Names & synonyms
6954-48-9BonaftonBonaphthon6-Bromo-1,2-naphthoquinone1,2-NAPHTHOQUINONE, 6-BROMO-TX6H0Q18AMNSC-37564DTXSID30219800UA 13082RefChem:120942DTXCID401422916-bromonaphthalene-1,2-dione
Show more names
Bonafton, 10 mM in DMSO
Bonaphthone1,2-Naphthalenedione, 6-bromo-6-BROMO-1,2-NAPHTHALENEDIONE6-bromo-1,2-dihydronaphthalene-1,2-dioneMFCD00464116Bonaphton6-Brom-1,2-naphthochinonNSC 37564
Database identifiers
- CAS
6954-48-9- PubChem CID
- 23384
- DTXSID
DTXSID30219800- ChEMBL
CHEMBL4303595- UNII
- TX6H0Q18AM
- Nikkaji
- J15.222F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 283
Physicochemical properties
- Melting point
- 168 °C · 168°C (rough estimate)
- Boiling point
- 363.7 · 363.7±42.0 °C(Predicted)
- Density
- 1.5961 · 1.5961 (rough estimate)
- refractive index
- 1.452 · 1.4520 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- form
- Solid
- color
- Yellow to brown
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 6 H0Q18AM · TX6H0Q18AM
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HazardClass
- IRRITANT
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesBonaphthone is an antiviral agent with anti-DNA and -RNA viral activities[1].
Suppliers13 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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