Basic information
- CAS
252004-42-5- Standard SMILES
Cc1cc(F)c(Br)cc1F- InChIKey
DZTNEQVEYQORQO-UHFFFAOYSA-N- Molecular formula
- C7H5BrF2
- Average molar mass
- 207.01 g/mol
- Monoisotopic mass
- 205.9542687
Names & identifiers
- Preferred name
- 1-Bromo-2,5-difluoro-4-methylbenzene
- IUPAC
- 1-bromo-2,5-difluoro-4-methylbenzene
- English name
- 1-BROMO-2,5-DIFLUORO-4-METHYLBENZENE
- Molecular formula
- C7H5BrF2
- Molecular weight
- 207.02
Names & synonyms
1-bromo-2,5-difluoro-4-methylbenzene252004-42-54-Bromo-2,5-difluorotoluene1-bromo-2,5-difluoro-4-methyl-benzeneMFCD07368736Benzene, 1-bromo-2,5-difluoro-4-methyl-SCHEMBL1478306SCHEMBL29056744SCHEMBL30228644DTXSID80382351DZTNEQVEYQORQO-UHFFFAOYSA-NCL9322
Show more names
4-Bromo-2,5-difiuorotoluene 97%
SBB093784AKOS0168462072-bromo-1,4-difluoro-5-methylbenzeneSB36192PS-10223DB-316293CS-0209287F075013
Database identifiers
- CAS
252004-42-5- PubChem CID
- 2782913
- DTXSID
DTXSID80382351
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Physicochemical properties
- Boiling point
- 184.4 · 184.4±35.0 °C(Predicted)
- Density
- 1.588 · 1.588±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- form
- liquid
- color
- Clear, colourless
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- T
- HS Code
- 2902900000 · 2902900000
Safety & regulation
Safety data
- hs_code
- 2902900000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- T
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers35 total
Aladdin Scientific[email protected]
上海欧堃化学有限公司(QQ 39130253)021-68712331 39130253 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [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]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
安徽合诺生物科技有限公司18455579438
上海相辉医药科技有限公司13761987713 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+86-13382787392 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
百科源(成都)科技有限公司15021461747 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
上海晟铱生物科技有限公司021-58957915 17721108391 · [email protected]
Related reactions
9 records
Compound notes
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