Completing data — refresh the page later to see the latest
Basic information
- CAS
2106-05-0- Standard SMILES
Nc1cc(Cl)ccc1F- InChIKey
JCYROOANFKVAIB-UHFFFAOYSA-N- Molecular formula
- C6H5ClFN
- Average molar mass
- 145.56 g/mol
- Monoisotopic mass
- 145.009455
Names & identifiers
- Preferred name
- 5-Chloro-2-fluoroaniline
- IUPAC
- 5-chloro-2-fluoroaniline
- English name
- 5-Chloro-2-fluoroaniline
- Molecular formula
- C6H5ClFN
- Molecular weight
- 145.56
Names & synonyms
5-Chloro-2-fluoroaniline2106-05-0JCYROOANFKVAIB-UHFFFAOYSA-DTXSID40175286EINECS 218-284-1NSC 10291RefChem:102302DTXCID7097777218-284-1InChI=1/C6H5ClFN/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H25-Chloro-2-fluorophenylamineBenzenamine, 5-chloro-2-fluoro-
Show more names
BUTTPARK 44\01-985-Chloro-2-fluoroani5-Chloro-2-fluoroaniline>5-Chloro-2-fluoroaniline98%5-Chloro-2-fluoroaniline 98%5-Chloro-2-fluoroaniline, 97+%
MFCD00069416EMD2GPF3XZ2-fluoro-5-chloroanilineNSC-102915-chloro-2-fluoro-anilineNSC10291UNII-EMD2GPF3XZ5-chloro-2-fluorobenzenamine
Database identifiers
- CAS
2106-05-0- PubChem CID
- 75015
- DTXSID
DTXSID40175286- UNII
- EMD2GPF3XZ
- EC Number
- 218-284-1
- Nikkaji
- J298.696E
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 99
Physicochemical properties
- Boiling point
- 102 · 102-105 °C/20 mmHg (lit.)
- Density
- 1.29 g/mL · 1.29 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.561(lit.)
- Flash point
- 219 °F · 219 °F
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- clear liquid
- pka
- 2.15 · 2.15±0.10(Predicted)
- color
- Colorless to Light orange to Yellow
- InChI
- InChI=1S/C6H5ClFN/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H2
- InChIKey
- JCYROOANFKVAIB-UHFFFAOYSA-N
- SMILES
- C1(N)=CC(Cl)=CC=C1F
- CAS DataBase Reference
- 2106 · 2106-05-0(CAS DataBase Reference)
- FDA UNII
- 2 GPF3XZ · EMD2GPF3XZ
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
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
This chemical does not meet GHS hazard criteria for 4% (2 of 50) of reports.
Warning
H302 (10%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (96%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (96%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (86%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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)
Aggregated GHS information provided per 50 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 2 of 50 reports by companies.；There are 8 notifications provided by 48 of 50 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory InformationStatus: Active Update: 15-12-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/32105
Hazard Classes and CategoriesAcute Tox. 4 (10%)；Skin Irrit. 2 (96%)；Eye Irrit. 2 (96%)；STOT SE 3 (86%)
Regulatory information
Regulatory InformationStatus: Active Update: 15-12-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/32105
Chemistry & industry
Applications
Uses5-Chloro-2-fluoroaniline is also involved in the synthesis of glucocorticoid receptor agonist for inflammation treatments.
Upstream & downstream products
Downstream products
Suppliers100 total
常州帝通化工有限公司+86-0519-88298848 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Related reactions
12 records
Compound notes
Loading…