Basic information
- CAS
1160653-95-1- Standard SMILES
O=Cc1c(O)ccc(Br)c1F- InChIKey
FCZNTUDWVQSVHC-UHFFFAOYSA-N- Molecular formula
- C7H4BrFO2
- Average molar mass
- 219.01 g/mol
Names & identifiers
- Preferred name
- 3-Bromo-2-fluoro-6-hydroxybenzaldehyde
- IUPAC
- 3-bromo-2-fluoro-6-hydroxybenzaldehyde
- English name
- 3-bromo-2-fluoro-6-hydroxybenzaldehyde
- Molecular formula
- C7H4BrFO2
- Molecular weight
- 219.01
Names & synonyms
3-Bromo-2-fluoro-6-hydroxybenzaldehyde1160653-95-13-bromo-2-fluoro-6-hydroxy-benzaldehydeMFCD15528068SCHEMBL276448BS-53177CS-0191302E910745-Bromo-6-fluorosalicylaldehydeSCHEMBL29743628FCZNTUDWVQSVHC-UHFFFAOYSA-NSY295726
Show more names
Benzaldehyde, 3-bromo-2-fluoro-6-hydroxy-
DB-4246343-bromanyl-2-fluoranyl-6-oxidanyl-benzaldehydeF629226
Database identifiers
- CAS
1160653-95-1- PubChem CID
- 57743354
- EC Number
- 193-563-8
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Boiling point
- 250.3 · 250.3±35.0 °C(Predicted)
- Density
- 1.826 · 1.826±0.06 g/cm3(Predicted)
- pka
- 6.62 · 6.62±0.23(Predicted)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H311-H331
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
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
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301-H311-H331
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
Chemistry & industry
Suppliers22 total
韶远科技(上海)有限公司4000665055 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
山东大有药物研发有限公司[email protected] 15165037910 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [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]
上海合必成医药科技有限公司19564164886 13701791899 · [email protected]
西安峥豪生物科技有限责任公司19829389091 · [email protected]
上海任跃化学科技有限公司021-62219190; 18321139117 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
安徽敬同药业股份有限公司13675155016 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
泰兴市海川生物科技有限公司19353112242 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
3 records
Compound notes
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