Basic information
- CAS
202865-78-9- Standard SMILES
Cc1cc(Br)c(N)cc1F- InChIKey
ZHSUEJWJGKIOGI-UHFFFAOYSA-N- Molecular formula
- C7H7BrFN
- Average molar mass
- 204.04 g/mol
- Monoisotopic mass
- 202.97459
Names & identifiers
- Preferred name
- 2-Bromo-5-fluoro-4-methylaniline
- IUPAC
- 2-bromo-5-fluoro-4-methylaniline
- English name
- 2-Bromo-5-fluoro-4-methylaniline
- Molecular formula
- C7H7BrFN
- Molecular weight
- 204.04
Names & synonyms
2-Bromo-5-fluoro-4-methylaniline202865-78-9DTXSID70378420RefChem:257343DTXCID20329447MFCD00142871benzenamine, 2-bromo-5-fluoro-4-methyl-benzenamine, 2-bromo-5-fluoro-4-methylSCHEMBL832549CHEMBL4935197AKOS0158351202-bromo-5-fluoro-4-methylphenylamine
Show more names
2-Bromo-5-fluoro-4-methylaniline98%2-broMo-5-fluoro-4-MethylbenzenaMine2-Bromo-5-fluoro-4-methylaniline 98%BENZENAMINE,2-BROMO-5-FLUORO-4-METHYL2-Bromo-5-fluoro-4-methyl-phenylamine4-Amino-5-bromo-2-fluorotoluene, 2-Bromo-5-fluoro-p-toluidine
2-bromo-5-fluoro-4-methyl-aniline2-Bromo-5-fluoro-4-methyl-phenylaSBB093216AC-1581PS-8158SB78283SY101280DB-045156
Database identifiers
- CAS
202865-78-9- PubChem CID
- 2773379
- DTXSID
DTXSID70378420- ChEMBL
CHEMBL4935197- EC Number
- 672-497-8
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 120
Physicochemical properties
- Melting point
- 39 · 39-41°C
- Boiling point
- 245.3 · 245.3±35.0 °C(Predicted)
- Density
- 1.589 · 1.589±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 1.95 · 1.95±0.10(Predicted)
- CAS DataBase Reference
- 202865 · 202865-78-9(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- Hazard Codes
- Xi
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 26 · 26-36/37/39
- Hazard Note
- Irritant
- HS Code
- 2921430090 · 2921430090
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
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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Safety data
- hs_code
- 2921430090
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers67 total
上海康恩博医药科技有限公司17510465506 · [email protected]
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
上海辅欣医药科技有限公司
Related reactions
2 records
Compound notes
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