Home > Compound List > Compound details
374-32-3 molecular structure
click picture or here to close

2,2,3,3-tetrafluorocyclobutan-1-ol

ChemBase ID: 302564
Molecular Formular: C4H4F4O
Molecular Mass: 144.0675728
Monoisotopic Mass: 144.01982763
SMILES and InChIs

SMILES:
C1C(C(C1(F)F)(F)F)O
Canonical SMILES:
OC1CC(C1(F)F)(F)F
InChI:
InChI=1S/C4H4F4O/c5-3(6)1-2(9)4(3,7)8/h2,9H,1H2
InChIKey:
FNENUTDUAXPVTF-UHFFFAOYSA-N

Cite this record

CBID:302564 http://www.chembase.cn/molecule-302564.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,2,3,3-tetrafluorocyclobutan-1-ol
IUPAC Traditional name
2,2,3,3-tetrafluorocyclobutan-1-ol
Synonyms
2,2,3,3-Tetrafluorocyclobutanol
2,2,3,3-四氟环丁醇
CAS Number
374-32-3
MDL Number
MFCD00190085
Beilstein Number
2429286

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar L19186 external link Add to cart
Data Source Data ID Price
Alfa Aesar
L19186 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 12.289218  H Acceptors
H Donor LogD (pH = 5.5) 1.0412536 
LogD (pH = 7.4) 1.041248  Log P 1.0412536 
Molar Refractivity 19.7503 cm3 Polarizability 7.8378625 Å3
Polar Surface Area 20.23 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
155-157°C expand Show data source
Flash Point
44°C(111°F) expand Show data source
Density
1.414 expand Show data source
Refractive Index
1.3680 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
UN Number
UN1987 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
III expand Show data source
Risk Statements
10-36/37/38 expand Show data source
Safety Statements
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H226-H315-H319-H335 expand Show data source
GHS Precautionary statements
P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
Purity
95% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle