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34941-91-8 molecular structure
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2-chloro-4-fluoropyridine

ChemBase ID: 13762
Molecular Formular: C5H3ClFN
Molecular Mass: 131.5354232
Monoisotopic Mass: 130.993805
SMILES and InChIs

SMILES:
c1cnc(cc1F)Cl
Canonical SMILES:
Fc1ccnc(c1)Cl
InChI:
InChI=1S/C5H3ClFN/c6-5-3-4(7)1-2-8-5/h1-3H
InChIKey:
FGSAQRJRWCZLOB-UHFFFAOYSA-N

Cite this record

CBID:13762 http://www.chembase.cn/molecule-13762.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-chloro-4-fluoropyridine
IUPAC Traditional name
2-chloro-4-fluoropyridine
Synonyms
2-Chloro-4-fluoropyridine
2-Chloro-4-fluoropyridine
2-氯-4-氟吡啶
CAS Number
34941-91-8
MDL Number
MFCD04039345
Beilstein Number
1634747
PubChem SID
160977069
PubChem CID
2782792

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.722488  LogD (pH = 7.4) 1.7224971 
Log P 1.7224972  Molar Refractivity 29.9836 cm3
Polarizability 11.133721 Å3 Polar Surface Area 12.89 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
140°C expand Show data source
140°C expand Show data source
Flash Point
54°C(129°F) expand Show data source
Density
1.456 expand Show data source
Refractive Index
1.5015 expand Show data source
Storage Warning
Flammable/Irritant expand Show data source
TOXIC, FLAMMABLE expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
UN Number
UN2929 expand Show data source
MSDS Link
Download expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
II expand Show data source
Risk Statements
10-23/24/25-37/38-41 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
TSCA Listed
false expand Show data source
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS05 expand Show data source
GHS06 expand Show data source
GHS Hazard statements
H301-H310-H330-H315-H335-H318-H226 expand Show data source
GHS Precautionary statements
P241-P301+P310-P303+P361+P353-P304+P340-P305+P351+P338-P320-P330-P361-P405-P501A expand Show data source
Purity
97% expand Show data source
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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