Basic information
- CAS
25373-69-7- Standard SMILES
[O-][n+]1c(Br)cccc1Br- InChIKey
YOJAFCXACCYASM-UHFFFAOYSA-N- Molecular formula
- C5H3Br2NO
- Average molar mass
- 252.89 g/mol
- Monoisotopic mass
- 250.85813792
Names & identifiers
- Preferred name
- 2,6-Dibromopyridine N-Oxide
- IUPAC
- 2,6-dibromo-1-oxidopyridin-1-ium
- English name
- 2,6-Dibromopyridine oxide
- Molecular formula
- C5H3Br2NO
- Molecular weight
- 252.89
Names & synonyms
2,6-Dibromopyridine N-oxideRefChem:445346803-395-52,6-Dibromopyridine 1-oxide25373-69-72,6-DIBROMOPYRIDINE OXIDE2,6-dibromo-1-oxidopyridin-1-ium2,6-dibromopyridin-1-ium-1-olateMFCD002340192,6-dibromopyridine-N-oxide2,6-Dibromopyridine N-Oxide, 98%D5015
Show more names
6P-0532,6-Dibromopyridine1-oxidePyridine, 2,6-dibromo-, 1-oxide2,6-dibromo pyridin2,6-dibromopyridin-1-ol2,6-Dibromopyridin N-oxideSCHEMBL7833132,6-dibromo pyridine 1-oxide
Database identifiers
- CAS
25373-69-7- PubChem CID
- 564873
- DTXSID
DTXSID70340460- EC Number
- 803-395-5
- Nikkaji
- J88.346H
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 25.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 91
Physicochemical properties
- Melting point
- 182 to · 182.0 to 186.0 °C
- Boiling point
- 387.1 · 387.1±22.0 °C(Predicted)
- Density
- 2.15 · 2.15±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -2.26 · -2.26±0.10(Predicted)
- form
- powder to crystal
- color
- White to Orange to Green
- InChI
- 1S/C5H3Br2NO/c6-4-2-1-3-5(7)8(4)9/h1-3H
- InChIKey
- YOJAFCXACCYASM-UHFFFAOYSA-N
- SMILES
- BrC1=[N+]([O-])C(Br)=CC=C1
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- hs_code
- 2933399990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers53 total
上海康恩博医药科技有限公司17510465506 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
武汉布林科技有限公司3456065315 13260619011 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
焦作沃恩生物科技有限责任公司0391-3702345 18739121806
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海钰康生物科技有限公司18939844854 · [email protected]
Related reactions
10 records
Compound notes
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