Home Nitriles 1-(2,4-difluorophenyl)cyclopentane-1-carbonitrile

1-(2,4-difluorophenyl)cyclopentane-1-carbonitrile

CAS No.:
1260758-81-3
Catalog Number:
AG01A5X1
Molecular Formula:
C12H11F2N
Molecular Weight:
207.2192
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Product Description
Catalog Number:
AG01A5X1
Chemical Name:
1-(2,4-difluorophenyl)cyclopentane-1-carbonitrile
CAS Number:
1260758-81-3
Molecular Formula:
C12H11F2N
Molecular Weight:
207.2192
MDL Number:
MFCD11036735
IUPAC Name:
1-(2,4-difluorophenyl)cyclopentane-1-carbonitrile
InChI:
InChI=1S/C12H11F2N/c13-9-3-4-10(11(14)7-9)12(8-15)5-1-2-6-12/h3-4,7H,1-2,5-6H2
InChI Key:
KKGKPRKHCCWHPO-UHFFFAOYSA-N
SMILES:
N#CC1(CCCC1)c1ccc(cc1F)F
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.086g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.224g/mol
Monoisotopic Mass:
207.086g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties