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1-(4-Chlorophenyl)-1-cyclobutanecarbonitrile Structure

1-(4-Chlorophenyl)-1-cyclobutanecarbonitrile

Chemical Properties

Boiling point 295 °C (lit.)
Density  1.137 g/mL at 25 °C (lit.)
refractive index  n20/D 1.548(lit.)
Flash point >230 °F
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Sparingly), Methanol (Slightly)
form  Oil
color  Clear Colourless to Pale Yellow
InChI InChI=1S/C11H10ClN/c12-10-4-2-9(3-5-10)11(8-13)6-1-7-11/h2-5H,1,6-7H2
InChIKey XQONXPWVIZZJIL-UHFFFAOYSA-N
SMILES C1(C2=CC=C(Cl)C=C2)(C#N)CCC1
CAS DataBase Reference 28049-61-8(CAS DataBase Reference)
FDA UNII 35U5QL7HSY
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H302+H312+H332
Precautionary statements P261-P264-P280-P301+P312-P302+P352+P312-P304+P340+P312
Hazard Codes  Xn
Risk Statements  20/21/22-36/37/38
Safety Statements  36-36/37/39-26
RIDADR  UN3276
WGK Germany  3
HazardClass  6.1
PackingGroup  III
HS Code  29269095
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
NFPA 704:
1
2 0

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1-(4-Chlorophenyl)-1-cyclobutanecarbonitrile Spectrum