Basic information
- CAS
471-44-3- Standard SMILES
O=C(O)C(F)Cl- InChIKey
JBIKZDFUXGHTHD-UHFFFAOYSA-N- Molecular formula
- C2H2ClFO2
- Average molar mass
- 112.49 g/mol
- Monoisotopic mass
- 111.9727352
Overview
structure in first source
Names & identifiers
- Preferred name
- Chlorofluoroacetic acid
- IUPAC
- 2-chloro-2-fluoroacetic acid
- English name
- Chlorofluoroacetic acid
- Molecular formula
- C2H2ClFO2
- Molecular weight
- 112.49
Names & synonyms
chlorofluoroacetic acid471-44-3DTXSID40870547RefChem:125414DTXCID008182632-chloro-2-fluoroacetic acidchloro(fluoro)acetic acidMFCD008715212-chloro-2-fluoro-acetic acidAcetic acid, chlorofluoro-C2H2ClFO2NSC 95117
Show more names
Chlorofluoroaceticacid98%Chlorofluoroacetic acid 98%Chloro(fluoro)aceticacid97%Acetic acid, 2-chloro-2-fluoro-2-chloro-2-fluoro-ethanoic acid4-[(2-amino-1-oxoethyl)amino]benzoic acid ethyl ester
CHLOROFLUOROACETICACID(2R)-2-chloro-2-fluoro-acetic acidAcetic acid,2-chloro-2-fluoro-NSC-95117SCHEMBL301084SCHEMBL3750293SCHEMBL11879523NSC95117
Database identifiers
- CAS
471-44-3- PubChem CID
- 98260
- DTXSID
DTXSID40870547- EC Number
- 687-915-4
- Nikkaji
- J1.021.305C
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 64.6
Physicochemical properties
- Melting point
- 150 · 150-153 °C
- Boiling point
- 162 °C · 162°C
- Density
- 1.532 · 1.532
- refractive index
- 1.4085 · 1.4085
- form
- liquid
- pka
- 1.51 · 1.51±0.10(Predicted)
- color
- Clear
- Specific Gravity
- 1.532 · 1.532
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 302 · H302+H312+H332-H314
- Precautionary statements
- 260 · P260-P271-P280
- Hazard Codes
- C,Xi
- Risk Statements
- 20 · 20/21/22-35
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 3265 · 3265
- Hazard Note
- Corrosive
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
Danger
H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (50%)
Safety data
- ridadr
- 3265
- hs_code
- 2915907098
- risk_code
- 20/21/22-35
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C,Xi
- hazard_note
- Corrosive
- safety_code
- 26-36/37/39-45
- hazard_class
- IRRITANT, CORROSIVE
- Hazard statements
- H302+H312+H332-H314
- Precautionary statements
- P260-P271-P280
Chemistry & industry
Pharmacology
Metabolism/MetabolitesChlorofluoroacetic acid has known human metabolites that include chloroacetyl-S-glutathione.
Applications
UsesChlorofluoroacetic Acid is a herbicide containing dicamba for gramineous lawns.
Suppliers21 total
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]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Aladdin Scientific[email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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