Basic information
- CAS
1344264-52-3- Standard SMILES
O=C(O)C(F)(F)c1c(F)cccc1F- InChIKey
YREOHYVJEZXUDY-UHFFFAOYSA-N- Molecular formula
- C8H4F4O2
- Average molar mass
- 208.11 g/mol
- Monoisotopic mass
- 208.01474201
Names & identifiers
- Preferred name
- 2-(2,6-Difluorophenyl)-2,2-difluoroacetic acid
- IUPAC
- 2-(2,6-difluorophenyl)-2,2-difluoroacetic acid
- English name
- 2-(2,6-difluorophenyl)-2,2-difluoroacetic acid
- Molecular formula
- C8H4F4O2
- Molecular weight
- 208.11
Names & synonyms
2-(2,6-difluorophenyl)-2,2-difluoroacetic acid1344264-52-3RefChem:452175872-543-9MFCD19637728SCHEMBL15647322YREOHYVJEZXUDY-UHFFFAOYSA-MYREOHYVJEZXUDY-UHFFFAOYSA-NUDC26452AKOS013353159SY146408CS-0223789
Show more names
α,α,2,6-Tetrafluorobenzeneacetic acidBenzeneacetic acid, α,α,2,6-tetrafluoro-
alpha,alpha,2,6-Tetrafluorobenzeneacetic acidEN300-116646G734222-(2,6-difluorophenyl)-2,2-difluoroaceticacid2-(2,6-difluorophenyl)-2,2-difluoro-acetic acidBenzeneacetic acid, alpha,alpha,2,6-tetrafluoro-F645991
Database identifiers
- CAS
1344264-52-3- PubChem CID
- 64036613
- EC Number
- 872-543-9
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 221
Physicochemical properties
- Boiling point
- 268.2 · 268.2±35.0 °C(Predicted)
- Density
- 1.518 · 1.518±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 0.71 · 0.71±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Suppliers7 total
成都神射手医药科技有限公司028-62577698; 19950139520 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
上海氟帝新材料科技有限公司021-31009277 13761216778 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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