Basic information
- CAS
3939-23-9- Standard SMILES
Brc1ccc2c(c1)Sc1ccccc1N2- InChIKey
JEWIAYIESCUSKQ-UHFFFAOYSA-N- Molecular formula
- C12H8BrNS
- Average molar mass
- 278.17 g/mol
- Monoisotopic mass
- 276.95608
Names & identifiers
- Preferred name
- 3-bromo-10H-phenothiazine
- IUPAC
- 3-bromo-10H-phenothiazine
- English name
- 3-bromo-10H-phenothiazine
- Molecular formula
- C12H8BrNS
- Molecular weight
- 278.17
Names & synonyms
3-bromo-10h-phenothiazine3939-23-9DTXSID20300599RefChem:277209DTXCID20251734959-931-4InChI=1/C12H8BrNS/c13-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)14-10/h1-7,1410H-Phenothiazine, 3-bromo-MFCD23160729NSC1378093-bromo-phenothiazineSCHEMBL239782
Show more names
SCHEMBL30769565DAA93923AKOS025295283NSC-137809BS-28297DB-105376EN300-7416400F826999
Database identifiers
- CAS
3939-23-9- PubChem CID
- 283308
- DTXSID
DTXSID20300599- EC Number
- 959-931-4
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 236
Physicochemical properties
- Melting point
- 181.5 °C · 181.5 °C
- Boiling point
- 410.5 · 410.5±34.0 °C(Predicted)
- Density
- 1.564 · 1.564±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C(protect from light)
- pka
- -1.87 · -1.87±0.20(Predicted)
- Appearance
- Light yellow to brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-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]
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers37 total
郑州海阔光电材料有限公司0371-67759225 13526468238 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
苏州纳什医药科技有限公司13482028355 · [email protected]
郑州海阔光电材料有限公司+86-371-55919009 +8615225108189 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
河南伊诺凯新材料有限公司15670530983 · [email protected]
QINGDAO KAIENSI INTERNATIONAL TRADE CO.,LTD.+86-0532-8699-9256 +86-18518128472 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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