Home Nitriles 1-ethylcyclopentane-1-carbonitrile

1-ethylcyclopentane-1-carbonitrile

CAS No.:
49826-26-8
Catalog Number:
AG01A0C5
Molecular Formula:
C8H13N
Molecular Weight:
123.1955
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Product Description
Catalog Number:
AG01A0C5
Chemical Name:
1-ethylcyclopentane-1-carbonitrile
CAS Number:
49826-26-8
Molecular Formula:
C8H13N
Molecular Weight:
123.1955
MDL Number:
MFCD20882675
IUPAC Name:
1-ethylcyclopentane-1-carbonitrile
InChI:
InChI=1S/C8H13N/c1-2-8(7-9)5-3-4-6-8/h2-6H2,1H3
InChI Key:
BKMKLODHNSECBK-UHFFFAOYSA-N
SMILES:
CCC1(CCCC1)C#N
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.105g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.199g/mol
Monoisotopic Mass:
123.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties