Home Nitriles Cyclohex-1-enecarbonitrile

Cyclohex-1-enecarbonitrile

CAS No.:
1855-63-6
Catalog Number:
AG003P4Z
Molecular Formula:
C7H9N
Molecular Weight:
107.1531
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Product Description
Catalog Number:
AG003P4Z
Chemical Name:
Cyclohex-1-enecarbonitrile
CAS Number:
1855-63-6
Molecular Formula:
C7H9N
Molecular Weight:
107.1531
MDL Number:
MFCD00013772
IUPAC Name:
cyclohexene-1-carbonitrile
InChI:
InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h4H,1-3,5H2
InChI Key:
GTMWGXABXQTZRJ-UHFFFAOYSA-N
SMILES:
N#CC1=CCCCC1
EC Number:
217-454-2
NSC Number:
177484
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
107.073g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
107.156g/mol
Monoisotopic Mass:
107.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties