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Home > Fluorides > 124305-68-6
124305-68-6 | Cyclopropanecarbonitrile, 1-[3-(trifluoromethyl)phenyl]-
CAS No: 124305-68-6 Catalog No: AG000LTY MDL No:MFCD07374416
Product Description
Catalog Number:
AG000LTY
Chemical Name:
Cyclopropanecarbonitrile, 1-[3-(trifluoromethyl)phenyl]-
CAS Number:
124305-68-6
Molecular Formula:
C11H8F3N
Molecular Weight:
211.1831
MDL Number:
MFCD07374416
IUPAC Name:
1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carbonitrile
InChI:
InChI=1S/C11H8F3N/c12-11(13,14)9-3-1-2-8(6-9)10(7-15)4-5-10/h1-3,6H,4-5H2
InChI Key:
CRIZCGCPHXFSCH-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)c1cccc(c1)C(F)(F)F
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.061g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.187g/mol
Monoisotopic Mass:
211.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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