Basic information
- CAS
1114809-02-7- Standard SMILES
O=Cc1c(Br)ccc(Cl)c1F- InChIKey
ILJCPNFAFWGTAR-UHFFFAOYSA-N- Molecular formula
- C7H3BrClFO
- Average molar mass
- 237.45 g/mol
- Monoisotopic mass
- 235.90398272
Names & identifiers
- Preferred name
- 6-Bromo-3-chloro-2-fluorobenzaldehyde
- IUPAC
- 6-bromo-3-chloro-2-fluorobenzaldehyde
- English name
- 6-bromo-3-chloro-2-fluorobenzaldehyde
- Molecular formula
- C7H3BrClFO
- Molecular weight
- 237.45
Names & synonyms
6-bromo-3-chloro-2-fluorobenzaldehyde1114809-02-7DTXSID20719283RefChem:104300DTXCID40670029867-256-0MFCD11520661SCHEMBL1016906AKOS016002925AS-32958CS-0060113EN300-180666
Show more names
2-bromo-5-chloro-6-fluorobenzaldehyde6-Bromo-3-chloro-2-fluorobenzaldehyde - [B71567]
Z1269242075A853979PUB809026-Bromo-3-chloro-2-fluoro-benzaldehydeSY387887DB-124243F223267
Database identifiers
- CAS
1114809-02-7- PubChem CID
- 56971740
- DTXSID
DTXSID20719283- EC Number
- 867-256-0
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- storage temp.
- 2 · Storage temp. 2-8°C
- form
- crystalline powder
- color
- Light lemon/amber
- InChI
- InChI=1S/C7H3BrClFO/c8-5-1-2-6(9)7(10)4(5)3-11/h1-3H
- InChIKey
- ILJCPNFAFWGTAR-UHFFFAOYSA-N
- SMILES
- C(=O)C1=C(Br)C=CC(Cl)=C1F
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
- HS Code
- 2912490090 · 2912490090
Safety & regulation
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
- hs_code
- 2912490090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Suppliers67 total
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
西安瑞成医药科技有限责任公司18291828687 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
南京代盟化工有限公司02566880956 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
北京依特能化学科技有限责任公司010-59484199 18611897322;18611897322 · [email protected]
上海群燊医药科技有限公司15316975816 · [email protected]
Related reactions
2 records
Compound notes
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