Basic information
- CAS
871507-79-8- Standard SMILES
Brc1ccc2cccc(Br)c2n1- InChIKey
DPABNLZUYUAAFA-UHFFFAOYSA-N- Molecular formula
- C9H5Br2N
- Average molar mass
- 286.95 g/mol
- Monoisotopic mass
- 284.87887
Names & identifiers
- Preferred name
- 2,8-Dibromoquinoline
- IUPAC
- 2,8-dibromoquinoline
- English name
- 2,8-Dibromoquinoline
- Molecular formula
- C9H5Br2N
- Molecular weight
- 286.95
Names & synonyms
2,8-Dibromoquinoline871507-79-8DTXSID80672820RefChem:83572DTXCID30623569897-123-22,8-DIBROMO-QUINOLINEMFCD09788633SCHEMBL339928SCHEMBL30657716DPABNLZUYUAAFA-UHFFFAOYSA-NAR3599
Show more names
Quinoline, 2,8-dibroMo-
AKOS015897057DS-2508SB39226DB-076858CS-0008659EN300-265488F050615F1905-6525
Database identifiers
- CAS
871507-79-8- PubChem CID
- 45925951
- DTXSID
DTXSID80672820- EC Number
- 897-123-2
- Nikkaji
- J2.245.117K
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Melting point
- 118 · 118-119 °C
- Boiling point
- 349.4 · 349.4±22.0 °C(Predicted)
- Density
- 1.923 · 1.923±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -2.16 · -2.16±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers21 total
苏州启航生物科技有限公司18151111370 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
西安华瑞致远生物科技有限公司18014474522 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
南京市华瑞生物医药科技有限公司18014824111
凯试（上海）科技有限公司021-50135380 · [email protected]
成都赛诺宁科技有限公司28-87999436 02887999436 · [email protected]
上海卡洛化学有限公司21-33526724 18930996265 · [email protected]
上海奈亦斯生物科技有限公司18321139117 · [email protected]
Related reactions
14 records
Compound notes
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